data_2rrl_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 2rrl _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.1 mtm . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 120.69 0.281 . . . . 71.54 111.08 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.24 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.23 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 71.34 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.51 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.15 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.55 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.32 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.42 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo . . . . . 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.34 112.088 -179.531 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.846 0.355 . . . . 74.14 110.495 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.2 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.41 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.03 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 33.23 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.52 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.54 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.24 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.22 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.24 111.207 -179.866 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 120.717 0.294 . . . . 73.24 110.962 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.53 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 74.24 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB3' ' HB2' ' A' ' 70' ' ' TRP . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.53 108.823 178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.4 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 62.24 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.11 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.32 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.04 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 44.03 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.604 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.01 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.32 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.03 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.403 ' HA ' HD11 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.42 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.01 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.55 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.22 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.03 111.273 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.34 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 72.04 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.688 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.44 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.15 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.41 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.54 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.31 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.42 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.55 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.11 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.34 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.449 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.21 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.53 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 75.44 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.44 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.15 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.22 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 73.24 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.449 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.14 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.51 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.587 HG11 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 71.12 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.42 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.31 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.41 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.68 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 74.54 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.01 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.13 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.4 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.3 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.31 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.44 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.34 112.199 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.31 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.42 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.21 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.11 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 62.32 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.643 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.1 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.35 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 73.35 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 71.31 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 73.01 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.32 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.13 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.54 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.2 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.14 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.15 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.488 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.55 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.22 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.33 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.403 HD11 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.53 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.43 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.409 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.21 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.33 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.01 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.35 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.55 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.34 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . 0.422 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.41 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.46 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.22 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.41 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.23 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.01 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.44 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.14 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.44 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.643 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.12 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.54 109.198 178.513 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.748 -0.464 . . . . 55.14 109.748 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.54 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.11 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.23 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.21 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 55.14 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.22 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.32 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.549 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.21 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . 0.549 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.31 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.14 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.23 110.635 -177.246 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.705 -0.479 . . . . 64.21 109.705 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.45 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.24 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.41 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.14 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 75.42 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.4 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo . . . . . 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.21 111.829 179.294 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 16' ' ' LEU . 2.2 pp . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.818 0.342 . . . . 72.42 110.936 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.53 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.42 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.04 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.14 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.14 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.15 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.41 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.32 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 62.51 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.03 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p . . . . . 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.43 109.938 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.235 0.337 0 CA-C-O 121.076 0.465 . . . . 75.11 111.166 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.45 110.527 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.34 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.32 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.43 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.486 HD22 ' H ' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.02 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.15 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.42 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.3 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.44 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.1 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 65.25 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.31 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.15 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.34 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 71.43 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.32 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.13 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.406 HG13 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.31 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.45 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.43 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.516 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.14 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.34 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.42 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.03 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.51 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.24 110.336 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.501 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.53 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.02 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 73.45 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.23 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.22 109.464 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.13 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.05 112.437 -172.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.542 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 75.12 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 73.41 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.52 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.15 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.42 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.427 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.34 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.43 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.21 108.575 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.43 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.53 110.633 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.535 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.52 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.516 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.34 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.42 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.3 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.54 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.44 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.11 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.21 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.43 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.47 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.44 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.12 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.535 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 12.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.42 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 74.44 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.34 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.22 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.12 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.13 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.12 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.13 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.31 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.34 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.43 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.43 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.1 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.23 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.41 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.24 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.452 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.44 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.51 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.23 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.406 HD21 HG13 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.12 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.44 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.41 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.35 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.21 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.3 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.54 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.23 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.1 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.35 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.51 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.02 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.35 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.45 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.53 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.03 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.23 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 64.32 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.34 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.34 111.463 179.287 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 120.863 0.363 . . . . 73.5 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.54 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.14 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.01 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.15 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.31 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.04 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.01 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.44 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.43 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.44 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.15 110.093 -179.077 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 121.106 0.479 . . . . 55.23 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 74.4 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.42 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.21 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.1 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.664 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.53 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.664 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.22 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.21 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.41 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.45 113.118 -177.056 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.582 0.23 . . . . 75.55 110.526 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.51 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.3 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.04 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.02 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.33 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.23 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 60.22 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.04 110.74 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.53 110.728 178.593 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.15 109.811 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.43 110.705 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 72.12 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.31 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.3 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 64.25 110.288 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.31 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.45 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.14 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.21 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.45 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.41 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 72.1 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.34 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.54 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.01 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.44 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 74.54 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.03 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.545 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 75.44 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.54 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.53 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.43 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.545 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 44.3 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.12 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.13 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.24 111.197 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.728 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.44 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.11 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 54.21 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.43 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.44 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.52 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.665 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.04 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.665 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.01 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.42 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.12 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.55 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.54 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.41 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.45 107.809 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.49 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.53 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.42 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 54.31 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.53 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.32 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.35 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.11 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.22 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 63.43 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.427 ' HB2' HD23 ' A' ' 145' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.21 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 71.2 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.03 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 71.13 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.12 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.49 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 64.44 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.21 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.44 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 75.51 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 71.14 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.24 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 52.13 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.24 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.15 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.32 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.13 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.33 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.01 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.11 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.425 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.53 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.41 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.443 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 74.44 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.24 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 72.23 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.44 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.34 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.45 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.53 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.4 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.23 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.12 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.23 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.52 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.431 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.15 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 64.43 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.42 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.15 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 62.2 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.14 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.11 110.777 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 120.852 0.358 . . . . 64.24 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.45 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.23 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 74.43 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . 0.442 ' HA ' ' OE1' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.22 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.24 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.34 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.23 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.51 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.42 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.21 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.41 109.148 179.43 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.444 -0.746 0 N-CA-C 108.863 -0.791 . . . . 74.14 108.863 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.42 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.52 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.45 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.41 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.44 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.3 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.32 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.33 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.23 111.665 179.811 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 N--CA 1.447 -0.608 0 CA-C-O 120.752 0.31 . . . . 55.24 110.503 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.14 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.13 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.31 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.42 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.03 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.22 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.21 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.43 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.1 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.45 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.14 110.37 178.181 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.747 0.308 . . . . 65.14 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 74.32 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.31 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 53.21 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.14 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.2 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.22 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 43.01 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.31 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.13 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.21 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.408 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.41 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.437 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.03 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 43.04 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 45.3 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.35 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.15 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.04 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.15 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 72.11 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 71.44 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.04 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.54 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.45 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.43 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.22 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.44 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.44 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.53 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 71.42 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.43 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.55 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.22 111.461 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.581 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.13 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.581 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.24 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.23 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.42 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.4 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.32 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.42 109.274 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.24 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.1 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.484 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 64.41 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 64.14 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.44 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.32 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.34 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.11 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.21 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.428 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.01 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.34 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.486 HE21 ' NE2' ' A' ' 147' ' ' GLN . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 70.25 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.04 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.1 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.437 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.44 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.32 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.45 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.04 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.53 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.24 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.21 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.21 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.22 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.44 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.31 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.31 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.44 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.34 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 62.12 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.35 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.4 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.44 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.53 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.4 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.43 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 72.42 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.34 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.33 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 73.15 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.41 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.44 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.31 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.21 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.486 ' NE2' HE21 ' A' ' 113' ' ' GLN . 28.1 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.52 110.837 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 64.24 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 75.4 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.32 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.14 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 74.2 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.986 0.422 . . . . 72.14 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.14 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.52 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 55.41 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.11 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 74.13 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.14 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 51.43 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.11 109.437 176.469 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.235 0.327 0 N-CA-C 109.594 -0.521 . . . . 72.33 109.594 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.42 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.34 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.42 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.54 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 61.54 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.23 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo . . . . . 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.33 112.074 179.532 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 16' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.391 0 CA-C-O 120.914 0.388 . . . . 70.0 110.943 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 74.15 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.34 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.52 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.23 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.52 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.13 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.55 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.51 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.22 109.318 175.7 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.087 -0.708 . . . . 70.21 109.087 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.536 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 74.42 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.34 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 74.15 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.35 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.54 110.633 -175.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.42 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 44.55 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.31 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.11 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.536 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.03 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.33 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.585 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.22 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.486 ' O ' HG22 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.12 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 55.15 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.1 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.35 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.2 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.41 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 71.33 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.01 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.41 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.03 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.24 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.54 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.03 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.34 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.576 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.42 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.32 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.446 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 2.3 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.51 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 74.45 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.24 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.464 ' CD1' HG22 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.03 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 72.13 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.41 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.45 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.468 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.31 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.31 111.345 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.33 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.33 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.464 HG22 ' CD1' ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 74.04 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.576 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.502 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.11 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.418 HD13 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.03 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.42 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.05 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.54 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.45 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.46 ' HB3' HE21 ' A' ' 144' ' ' GLN . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.05 108.419 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.418 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 62.2 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.13 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.403 ' CD2' HD11 ' A' ' 105' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 73.5 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.43 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.32 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.34 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.422 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.14 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.2 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.14 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.01 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.3 109.176 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.32 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.32 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.41 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.41 109.693 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.41 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.456 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.34 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.24 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.52 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 73.04 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.24 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.33 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.41 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.12 110.542 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.14 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.45 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.3 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 60.12 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.12 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.05 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.46 HE21 ' HB3' ' A' ' 111' ' ' GLN . 18.4 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.45 110.186 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.02 109.803 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.44 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.44 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.21 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.22 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.4 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.02 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.1 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 . . . . . 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 63.33 111.121 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.057 0.456 . . . . 52.2 110.355 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.12 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.53 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.05 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.44 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.23 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.22 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 62.01 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.43 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.33 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 71.31 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.12 110.451 -177.403 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 121.028 0.442 . . . . 72.34 112.191 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.11 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 45.5 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.24 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 72.54 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.2 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 61.34 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.41 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.43 111.672 -179.205 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.237 0.437 0 CA-C-O 120.727 0.299 . . . . 74.42 110.613 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 74.32 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.33 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.23 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.13 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.21 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.02 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.14 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 74.2 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 60.14 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.544 ' HZ2' ' HB3' ' A' ' 26' ' ' LYS . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.13 110.884 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.22 108.55 176.193 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.506 -0.553 . . . . 44.12 109.506 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.42 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.04 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.14 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.04 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.44 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 74.02 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.449 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.32 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 73.44 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.55 111.143 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.12 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 74.2 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 75.53 109.135 176.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.13 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.14 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.52 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 70.41 110.879 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.474 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 64.44 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.52 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.14 111.484 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.45 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.41 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.2 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.44 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.04 109.713 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.3 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 65.45 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 102' ' ' HIS . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.15 112.842 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.42 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.44 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.2 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.45 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.473 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.473 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.33 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.443 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 71.01 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.03 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.21 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.41 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.404 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 1.1 m80 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.41 110.222 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 75.45 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.483 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 71.4 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.13 110.91 -177.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.44 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.44 111.063 -172.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.53 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.12 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.41 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.442 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.21 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.51 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.483 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.3 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.43 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 72.32 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.803 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 71.13 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.02 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.23 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' SER . . . . . 0.416 ' OG ' HG23 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.41 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.24 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.416 HG23 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.23 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.444 ' HA ' ' NE ' ' A' ' 124' ' ' ARG . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.41 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.12 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 64.4 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.21 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.34 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.61 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.33 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.4 112.587 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.11 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.61 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 65.31 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.42 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 135' ' ' ARG . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.54 111.745 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 72.4 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.02 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.22 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.42 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.44 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.41 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.15 110.768 -179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.14 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 71.43 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.41 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.43 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.23 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.34 109.529 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.403 HG23 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.43 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.11 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.51 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.21 106.384 179.37 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 109.573 -0.528 . . . . 74.23 109.573 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.33 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 65.1 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.52 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.42 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.13 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.42 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 75.13 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.04 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.12 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 41.14 109.983 -179.327 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 62.24 110.662 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.21 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 72.25 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.12 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.457 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.32 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.457 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.42 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.41 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 75.44 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.12 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.51 111.954 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.872 0.367 . . . . 63.33 111.091 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.2 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 75.22 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.15 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.55 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.32 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.11 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.53 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.13 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.44 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.42 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.12 109.891 177.199 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.14 111.182 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.31 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.15 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.53 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.4 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.05 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.13 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.42 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.53 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 72.02 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.11 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.12 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 73.44 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 79' ' ' MET . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.22 111.03 177.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.03 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.41 112.491 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.13 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.502 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.21 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.12 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.32 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 74.21 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.55 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.42 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 64.2 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.24 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.34 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.24 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.1 110.125 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.492 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.15 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.32 112.488 -175.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.634 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 39.0 m80 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.634 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.41 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.34 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.12 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.13 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.55 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.34 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.33 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.53 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.13 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.47 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.01 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.463 HD13 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.14 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.54 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.23 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.32 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.04 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.44 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.02 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.463 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.1 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.558 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.43 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.02 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.47 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.41 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.458 ' SD ' HD13 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.42 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.33 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.12 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.15 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.15 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.51 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 75.1 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.33 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 65.43 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 43.13 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.13 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.458 HD13 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.02 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.15 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.559 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.2 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 74.25 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.02 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.559 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.2 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.55 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.23 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.11 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.35 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.13 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.44 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.35 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.04 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.22 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.41 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.22 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.14 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.33 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.558 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.03 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 72.44 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 64.41 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.1 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.12 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.12 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.03 109.607 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 120.94 0.4 . . . . 51.4 110.706 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.51 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.03 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.21 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.31 111.323 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.15 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 74.21 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.33 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.52 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.2 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.24 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.52 110.476 -178.173 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 C--O 1.238 0.491 0 N-CA-C 109.975 -0.38 . . . . 74.31 109.975 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.05 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.34 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.23 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.21 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.32 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.52 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 72.55 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.15 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.12 111.505 179.57 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 121.015 0.436 . . . . 71.01 110.705 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 73.0 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.34 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.01 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.42 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.22 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.11 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.43 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.41 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.42 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.12 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p . . . . . 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.31 110.754 178.694 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.448 -0.574 0 CA-C-O 121.001 0.429 . . . . 73.41 110.317 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.54 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 60.23 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.24 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.51 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 74.54 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.54 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.23 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.474 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.2 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.42 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.43 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.54 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.22 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 63.14 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.2 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.24 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.23 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 63.24 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.24 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.52 111.161 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.14 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.446 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.34 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.42 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.3 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 55.43 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 73.14 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.11 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.23 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.478 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.41 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 62.31 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.34 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.515 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.33 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.52 111.901 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 75.35 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.14 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.04 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.463 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.41 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.01 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.12 110.372 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.435 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.33 110.933 176.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.52 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.13 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 73.24 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 74.43 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.24 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.03 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 75.22 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.34 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.14 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.24 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.52 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.51 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB3' HD22 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.41 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.12 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.05 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.12 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.1 108.695 -176.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 71.21 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 64.24 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.52 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 70.33 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.41 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.51 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.03 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.41 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.54 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.35 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.21 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.05 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.466 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.12 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.52 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.466 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.35 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.466 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 64.43 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 73.12 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.435 ' CB ' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.44 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . 0.406 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 14.1 mm100 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.33 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.23 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.23 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.42 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.33 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.52 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.12 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.23 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.01 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 17.4 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.44 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' SER . . . . . 0.428 ' HG ' ' C ' ' A' ' 147' ' ' GLN . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.03 110.384 -177.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.02 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.34 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.13 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.22 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.955 179.445 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.816 0.341 . . . . 75.32 110.771 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.11 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.1 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.12 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.41 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 63.13 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.41 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.41 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.42 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.41 111.52 -178.722 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 110.193 -0.299 . . . . 73.23 110.193 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.45 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 64.24 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.33 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.44 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.22 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.31 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 73.24 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.4 112.537 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo . . . . . 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.45 112.098 179.092 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-O 120.9 0.381 . . . . 71.52 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.15 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.12 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.44 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.1 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.21 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.51 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.11 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.54 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.51 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.53 110.434 -179.238 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.002 -0.74 . . . . 61.51 109.002 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 53.42 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.13 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.53 110.76 176.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.43 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.23 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.41 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.33 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.04 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.01 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.44 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.527 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.1 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.672 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.2 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.509 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.14 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.4 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.12 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.13 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.648 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.13 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.43 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.419 ' CE1' ' HB1' ' A' ' 89' ' ' ALA . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.44 111.757 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.23 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 75.15 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.41 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.513 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.21 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 75.55 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.419 ' HB1' ' CE1' ' A' ' 81' ' ' PHE . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 50.35 111.214 -178.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.42 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.13 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.51 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.02 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.497 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.4 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.497 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.23 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.04 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.34 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 50.23 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.24 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.55 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.2 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 61.25 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.495 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.43 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.53 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.14 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.11 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.42 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.23 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.12 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.13 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.657 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.53 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.51 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.1 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.13 111.519 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.495 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.11 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.43 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.493 HG11 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.44 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.22 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.14 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.23 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.44 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.33 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.424 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.52 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.35 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 53.5 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.45 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.42 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.44 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.41 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.407 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.24 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.51 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.42 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.41 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 75.21 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.14 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.03 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.34 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 75.24 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.52 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.03 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.15 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.41 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.559 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 65.14 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.32 110.044 178.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.41 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.442 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.52 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.23 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 64.15 112.265 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.15 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.493 ' H ' HG11 ' A' ' 117' ' ' VAL . 37.2 mt-10 . . . . . 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.24 111.647 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.813 0.34 . . . . 63.35 110.768 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.05 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.43 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.24 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.35 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.13 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 72.02 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.35 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.41 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.13 109.654 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 74.21 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.82 0.343 . . . . 55.1 111.195 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 74.14 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.41 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 61.51 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.13 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.493 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.1 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.493 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.33 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.3 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.34 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo . . . . . 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.12 111.031 178.267 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.838 0.351 . . . . 64.22 110.312 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 71.13 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.53 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.04 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.4 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.23 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.22 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.41 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.43 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.41 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p . . . . . 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 64.25 108.187 176.384 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 120.673 0.273 . . . . 75.11 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 75.23 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 74.14 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 65.45 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.24 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.34 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.01 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 75.04 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.41 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.447 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.14 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.13 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.11 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 75.12 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.14 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.22 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.11 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.14 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.43 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.43 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.51 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.51 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.43 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.55 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.44 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.21 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.542 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 48.6 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.01 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.32 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 44.21 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.15 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.1 mp0 -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.05 109.038 175.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.22 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.52 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 72.21 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.3 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.23 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.33 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.42 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.446 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.53 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.21 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.43 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 74.34 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.13 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.22 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.3 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.555 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.15 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.24 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.12 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.552 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.12 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.41 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.552 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.42 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.15 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.4 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.41 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.458 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.53 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.48 HG11 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 75.34 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.34 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 72.11 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.23 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.51 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.45 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 74.11 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.458 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.41 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.13 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.32 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.52 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.438 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.51 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 74.15 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.563 ' O ' HG23 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.04 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 73.42 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.21 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.563 HG23 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.24 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.11 110.06 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.403 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.44 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 75.33 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.23 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . 0.403 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.32 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.24 110.124 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.34 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.15 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.33 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.03 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 116' ' ' MET . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.21 109.185 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.428 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.33 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.48 ' H ' HG11 ' A' ' 117' ' ' VAL . 42.3 mt-10 . . . . . 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.23 109.519 -176.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 110.051 -0.352 . . . . 73.23 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.13 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.41 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.33 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 72.05 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.14 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 74.21 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.23 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.14 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.04 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.01 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 71.54 110.821 -179.232 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 110.118 -0.327 . . . . 65.1 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.13 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.44 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.31 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.12 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.1 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.41 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.04 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 43.34 111.852 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 120.758 0.313 . . . . 72.34 110.448 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.01 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.31 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.41 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.33 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.53 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.44 ' C ' ' HG1' ' A' ' 23' ' ' THR . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.21 110.799 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.44 ' HG1' ' C ' ' A' ' 22' ' ' ALA . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.12 109.231 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.44 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.23 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 71.14 111.044 -179.771 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.991 -0.374 . . . . 64.1 109.991 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.34 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.44 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.22 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.21 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.512 HD22 ' H ' ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 74.22 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 71.31 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.12 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.42 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.33 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.53 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.35 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.658 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.13 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.53 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.11 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.1 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.483 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.12 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.421 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.54 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.424 HD11 ' HD3' ' A' ' 83' ' ' ARG . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.42 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.14 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.05 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.424 ' HD3' HD11 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.32 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.15 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.31 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 72.1 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.1 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.4 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.4 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.22 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.42 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.04 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.417 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.24 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.417 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.42 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.01 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.497 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.14 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.497 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.14 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.03 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.11 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 62.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 75.23 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.54 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.472 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 74.33 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.428 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 64.25 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.34 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.35 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.52 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 73.01 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.44 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.13 109.354 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.4 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.23 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 74.42 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.53 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.623 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.22 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.1 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.52 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.43 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.44 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.04 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.41 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.03 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.22 110.347 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.02 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 73.24 111.972 177.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.03 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.1 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.23 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 70.22 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.11 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.4 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.21 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.04 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.11 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.04 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.52 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 74.32 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.24 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.489 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.34 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.21 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.41 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.12 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.52 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.43 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.623 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.43 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.14 108.293 176.068 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 110.206 -0.294 . . . . 73.53 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.54 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 61.52 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.32 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.01 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.23 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.4 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.53 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 72.53 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.44 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.35 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 73.41 110.5 -179.156 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 C--O 1.239 0.515 0 N-CA-C 109.921 -0.4 . . . . 74.43 109.921 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.31 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.33 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.24 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.23 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.34 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.34 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.34 112.694 -178.638 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.932 0.396 . . . . 63.11 110.996 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 72.25 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.45 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 75.14 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.52 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.31 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.33 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.13 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 62.32 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 70.33 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.33 109.877 178.671 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.697 0.284 . . . . 74.02 110.572 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.23 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.22 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 71.41 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.21 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.43 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.05 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.21 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.13 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.14 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 74.45 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.23 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.12 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.02 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.517 ' O ' HG22 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.54 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.13 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.466 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.1 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.44 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.44 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.433 ' CZ ' ' HB1' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.13 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.51 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 64.41 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.24 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.22 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.23 110.69 178.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 71.13 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.21 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.11 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.31 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.425 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.24 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.466 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 72.34 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.477 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.12 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.477 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.35 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.43 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.24 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.34 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.33 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.12 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.45 109.468 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.34 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 64.32 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.45 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.21 110.616 -176.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.22 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.54 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.4 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.52 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.43 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.22 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.34 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.01 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.31 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.43 109.885 -178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.15 110.322 178.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 63.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 65.44 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.34 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 73.32 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.31 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 73.04 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.45 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.44 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.02 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.479 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.35 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.05 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.41 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.558 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.42 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.69 ' O ' HG23 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.14 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.33 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.01 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.42 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 75.53 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.4 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 74.43 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.14 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 61.44 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.12 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.31 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.43 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.22 111.117 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.41 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.14 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.24 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.639 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.23 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 73.24 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.24 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.42 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 . . . . . 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.13 110.94 178.493 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.577 0 N-CA-C 109.911 -0.403 . . . . 73.14 109.911 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.54 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.34 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.53 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.55 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 75.51 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 73.2 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 74.03 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.35 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.4 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.43 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.54 110.299 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 121.128 0.49 . . . . 32.11 111.716 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 32.04 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.43 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.42 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.13 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.15 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.12 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.3 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.2 112.208 -178.567 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 121.06 0.457 . . . . 72.14 111.248 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.45 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.21 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.24 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.41 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.11 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.03 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.21 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.51 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.15 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 65.31 111.364 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.251 -0.648 . . . . 74.45 109.251 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.11 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.33 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.02 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.44 111.732 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.53 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.14 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.23 111.262 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.34 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.21 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.3 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.5 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.2 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.21 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.55 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.508 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.32 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.31 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.586 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.13 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.42 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CZ ' ' HB1' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.44 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.32 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.586 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 74.43 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.34 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.4 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.32 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.44 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.01 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.65 ' HB1' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.43 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.23 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.41 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.52 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.32 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.514 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.02 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.2 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.35 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 95' ' ' PRO . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.51 107.949 173.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.57 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.24 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.33 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 73.04 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.31 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.488 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.56 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.3 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.53 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.11 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.31 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.21 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.15 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.44 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.12 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.447 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.22 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.647 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.3 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.13 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.647 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.488 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 54.03 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.44 109.703 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.21 112.471 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 75.5 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.12 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.32 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 74.35 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.43 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 62.15 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.32 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.15 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 64.25 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.33 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.54 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.24 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.564 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.03 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.461 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.33 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.2 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.03 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.54 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.04 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.51 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.12 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.11 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 73.55 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.24 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.04 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.02 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.05 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' A' ' 147' ' ' GLN . 0.1 OUTLIER -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.11 109.648 177.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.03 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 71.42 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.01 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.22 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 63.03 110.163 178.066 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 120.884 0.373 . . . . 62.33 110.495 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.03 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.45 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.43 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.24 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.55 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.32 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.21 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 74.51 109.083 -179.038 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 120.905 0.383 . . . . 74.41 110.47 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.15 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 61.42 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.33 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.22 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.03 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.02 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.21 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.23 111.549 179.097 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.446 -0.67 0 CA-C-O 121.1 0.476 . . . . 75.23 110.087 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.4 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.42 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.24 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.53 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.12 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.14 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.33 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.52 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.51 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.02 112.043 -179.345 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.916 0.389 . . . . 54.24 110.844 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.41 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.45 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.14 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.02 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 63.33 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.12 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.419 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 71.33 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.42 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.13 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.419 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.11 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.41 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.32 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.44 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.607 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.23 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.33 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.31 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.607 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.31 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.33 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.449 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.22 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.33 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 75.01 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.51 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.32 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.35 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.42 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 88' ' ' SER . 3.9 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.13 111.475 -178.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.41 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 86' ' ' GLN . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.33 109.705 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.21 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.34 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.414 HD11 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 63.43 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.568 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.13 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' A' ' 91' ' ' LEU . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.23 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.679 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.33 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.679 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.13 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.13 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 72.1 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.1 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.568 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.55 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.3 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.21 108.883 177.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.23 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.448 HG23 ' H ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.14 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 72.22 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.22 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.11 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.52 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.24 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.52 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.3 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.13 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.12 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 26.7 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 74.13 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.53 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 74.24 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.13 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.44 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 75.44 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.2 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.2 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.32 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.523 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.13 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.4 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.01 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 74.54 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 74.11 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.52 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.22 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.42 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.459 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.34 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.34 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 70.44 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.32 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.13 110.049 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.13 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.14 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.44 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.31 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.52 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.53 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.24 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.13 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.23 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 71.2 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.34 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.22 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.41 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.53 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.42 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.522 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.41 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.24 110.41 178.423 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.227 -0.286 . . . . 74.53 110.227 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.12 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.23 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.23 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.41 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 74.35 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.21 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.22 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.12 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.3 109.959 178.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 CA--C 1.509 -0.611 0 N-CA-C 108.981 -0.748 . . . . 73.11 108.981 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 61.11 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.34 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.44 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.23 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.12 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.02 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.14 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.14 111.846 179.638 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.057 0.456 . . . . 74.34 110.989 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.43 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 75.11 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.54 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.55 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.45 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.24 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.32 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.14 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.44 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.21 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.44 110.401 -178.793 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.318 -0.623 . . . . 72.53 109.318 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 72.31 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.12 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.2 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.34 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.22 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.13 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 72.14 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.32 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.54 109.81 177.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.4 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.12 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.41 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.13 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.33 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.1 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.31 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.596 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 74.01 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.44 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.44 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.596 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.35 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 73.1 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.33 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.04 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.13 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.51 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.44 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.14 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 47.6 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.22 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.54 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.12 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.32 110.246 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.498 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 75.14 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.13 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.13 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.455 ' H ' ' C ' ' A' ' 95' ' ' PRO . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.12 108.542 174.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.03 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.54 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.13 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.05 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.33 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.23 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.476 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 73.12 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.3 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.24 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.43 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.53 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.14 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.425 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.53 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.22 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.529 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.3 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.42 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.42 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.22 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.43 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.1 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 71.53 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 71.51 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.31 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.04 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.24 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 54.12 110.371 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.12 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.23 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 63.42 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.22 110.267 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.505 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.33 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.41 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 75.34 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 75.01 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.35 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 72.03 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.42 111.308 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.41 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.12 111.291 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.41 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.34 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.32 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 70.24 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.24 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . 0.441 HD13 ' H ' ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 73.24 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.43 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.11 111.149 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.54 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.11 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.01 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 53.11 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.41 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' SER . . . . . 0.414 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.41 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' SER . . . . . 0.786 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.3 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.51 110.091 -176.845 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.942 -0.392 . . . . 63.41 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.11 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.43 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.21 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 75.21 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.11 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.31 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.3 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.12 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.41 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.35 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.23 110.295 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 2' ' ' MET . 76.0 t60 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.851 -0.426 . . . . 74.32 109.851 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.426 ' HG3' ' CD2' ' A' ' 1' ' ' HIS . 71.1 mtm 73.8 171.08 0.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.502 0.721 . . . . 71.54 111.08 -177.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.24 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.23 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 71.34 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.51 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.15 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.55 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.32 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.42 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.29 154.34 68.61 Favored 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.34 112.088 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.3 84.52 0.3 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.095 -0.502 . . . . 61.24 110.857 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.8 mt -152.19 149.75 29.09 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.184 -0.673 . . . . 61.44 109.184 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -88.11 117.49 68.48 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-O 120.587 0.232 . . . . 74.41 111.258 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.8 137.76 12.84 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.528 2.152 . . . . 55.32 110.938 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp -161.67 115.52 1.91 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.846 0.355 . . . . 74.14 110.495 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.2 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.41 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.03 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 33.23 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.52 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.54 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.24 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.22 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t 72.95 147.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.24 111.207 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 67.96 89.91 0.1 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.832 -0.622 . . . . 72.15 110.422 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.8 p -171.25 146.19 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 115.378 -0.828 . . . . 44.55 109.511 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.4 t70 70.03 167.07 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.022 0.529 . . . . 73.15 110.74 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -150.78 145.23 18.05 Favored Pre-proline 0 C--N 1.32 -0.703 0 O-C-N 122.228 -0.295 . . . . 65.32 110.752 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.48 143.28 68.66 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.039 2.493 . . . . 71.13 112.9 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.91 130.56 9.59 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 122.99 2.46 . . . . 54.01 112.393 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -74.65 120.72 82.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.992 -0.549 . . . . 51.03 111.401 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 18.6 Cg_exo -66.66 143.05 66.55 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.623 2.215 . . . . 74.23 111.835 178.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.9 m -145.12 145.46 20.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.231 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.1 m -151.37 139.04 19.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.493 -0.321 . . . . 73.12 110.273 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -117.0 166.32 12.33 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.209 -0.293 . . . . 72.35 110.209 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.53 -99.67 0.12 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 74.44 112.346 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 63.96 -172.51 0.17 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.095 0.558 . . . . 73.43 111.508 -179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.92 -30.32 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.375 -0.375 . . . . 71.42 110.946 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.9 mtp 65.91 99.11 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.496 0 C-N-CA 123.239 0.615 . . . . 74.55 111.672 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.68 112.57 1.51 Allowed 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 122.499 2.132 . . . . 71.2 111.587 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -83.94 154.48 23.35 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.038 -0.528 . . . . 75.12 109.882 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -147.85 118.33 7.44 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.665 -0.495 . . . . 53.23 109.665 -177.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.6 m -68.25 135.88 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.175 -0.466 . . . . 75.42 110.912 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 p -68.73 111.65 4.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.91 -0.586 . . . . 44.22 110.933 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.15 138.98 52.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.324 -0.398 . . . . 72.24 110.571 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.2 m -86.33 138.18 32.02 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.963 -0.562 . . . . 74.14 110.083 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.11 168.12 19.43 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.512 -0.551 . . . . 73.13 109.512 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -78.66 141.68 60.52 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.738 -0.467 . . . . 70.43 109.738 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 141.23 92.96 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.088 2.525 . . . . 70.52 111.978 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 53' ' ' LEU . 1.1 pp -77.49 135.23 65.22 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 116.304 -0.407 . . . . 62.4 111.356 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 33.5 Cg_exo -59.65 138.26 82.26 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.794 2.329 . . . . 73.23 111.582 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.0 m -147.43 -173.14 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.222 -0.445 . . . . 73.15 110.781 -177.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.04 -176.4 4.49 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.154 -0.684 . . . . 55.14 109.154 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -73.51 121.42 20.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.808 -0.442 . . . . 73.24 109.808 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 135.92 89.67 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.193 -0.458 . . . . 63.33 111.422 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.515 ' O ' HG23 ' A' ' 60' ' ' VAL . 43.9 Cg_endo -70.96 119.53 6.38 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.409 2.073 . . . . 74.05 110.267 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 59' ' ' PRO . 4.0 m 55.33 -176.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.068 0.947 . . . . 73.24 110.962 -175.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.53 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 74.24 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB3' ' HB2' ' A' ' 70' ' ' TRP . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.53 108.823 178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.4 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 62.24 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.11 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.32 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.04 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 44.03 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.604 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.01 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.32 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.03 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.403 ' HA ' HD11 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.42 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.01 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.55 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.22 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.03 111.273 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.34 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 72.04 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.688 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.44 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.15 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.41 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.54 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.31 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.42 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.55 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.11 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.34 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.449 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.21 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.53 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 75.44 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.44 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.15 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.22 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 73.24 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.449 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.14 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.51 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.587 HG11 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 71.12 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.42 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.31 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.41 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.68 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 74.54 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.01 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.13 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.4 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.3 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.31 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.44 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.34 112.199 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.31 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.42 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.21 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.11 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 62.32 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.643 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.1 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.35 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 73.35 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 71.31 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 73.01 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.32 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.13 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.54 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.2 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.14 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.15 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.488 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.55 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.22 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.33 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.403 HD11 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.53 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.43 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.409 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.21 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.33 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.01 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.35 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.55 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.34 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.422 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.41 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.46 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.22 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.41 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.23 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.01 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.44 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.14 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.44 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.643 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.12 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -152.84 -46.84 0.1 Allowed 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.54 109.198 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 69.9 m -155.55 152.45 28.84 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.933 -0.765 . . . . 71.54 108.933 177.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . 0.455 ' HB2' ' OG ' ' A' ' 151' ' ' SER . 60.4 t80 -100.76 127.31 47.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.899 0.38 . . . . 72.12 110.833 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.92 118.85 3.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.748 -0.66 . . . . 55.14 109.748 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.54 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.11 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.23 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.21 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 55.14 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.22 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.32 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.549 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.21 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . 0.549 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.31 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.14 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p -170.66 179.8 3.15 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.23 110.635 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -160.68 -174.06 4.26 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.154 -0.475 . . . . 75.15 109.825 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 . . . . . 0 C--O 1.252 1.203 0 CA-C-O 118.385 -0.817 . . . . 74.44 110.164 177.655 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.1 m80 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.704 0.287 . . . . 73.12 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -87.47 139.85 30.13 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.705 -0.479 . . . . 64.21 109.705 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.45 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.24 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.41 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.14 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 75.42 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.4 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.79 145.0 40.09 Favored 'Trans proline' 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.21 111.829 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.64 134.67 4.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.117 -0.492 . . . . 73.51 110.506 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.8 mt -151.92 161.91 41.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.14 -0.482 . . . . 72.12 109.771 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 35.7 m -84.72 119.1 72.41 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.484 -0.325 . . . . 74.42 110.303 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -79.45 167.38 21.18 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.219 1.946 . . . . 74.44 111.227 178.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 16' ' ' LEU . 2.2 pp -160.92 152.99 20.01 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.818 0.342 . . . . 72.42 110.936 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.53 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.42 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.04 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.14 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.14 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.15 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.41 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.32 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 62.51 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.03 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.9 26.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.43 109.938 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -76.55 97.1 4.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.52 -0.764 . . . . 64.13 110.523 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.2 p -169.88 142.08 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.151 -0.477 . . . . 54.34 110.419 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -154.98 144.02 20.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.397 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -151.71 95.46 3.26 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.283 -0.417 . . . . 74.33 110.115 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.25 133.68 29.19 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.723 2.282 . . . . 71.15 111.523 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.48 133.81 44.8 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.38 2.053 . . . . 74.04 111.417 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.79 120.7 77.73 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.272 -0.422 . . . . 75.1 110.974 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 36' ' ' VAL . 85.5 Cg_endo -85.26 -144.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.01 2.473 . . . . 72.45 110.7 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.443 ' H ' ' HB2' ' A' ' 35' ' ' PRO . 18.9 m -75.19 121.1 26.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.261 0.553 . . . . 72.12 109.597 178.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.3 p -85.59 97.2 9.95 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.427 0.632 . . . . 73.31 112.504 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -126.52 149.53 49.32 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.727 -0.669 . . . . 74.12 109.752 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 95.2 80.42 1.51 Allowed Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.467 -0.873 . . . . 72.35 111.617 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -163.46 38.4 0.09 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.428 0.633 . . . . 64.4 109.429 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 57.7 0.22 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.042 -0.981 . . . . 74.14 109.343 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.63 153.0 64.46 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.011 -0.995 . . . . 41.44 110.274 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.44 121.85 9.0 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.618 2.212 . . . . 71.11 112.116 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -81.69 142.46 32.67 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.785 -0.643 . . . . 64.45 110.113 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 91.9 mt -146.7 -176.53 5.23 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.765 -0.457 . . . . 74.11 109.765 -178.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.0 m -159.6 144.55 15.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.952 0.406 . . . . 73.04 110.61 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 21.5 m -102.55 174.42 5.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.958 -0.565 . . . . 72.32 109.97 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.41 90.32 2.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.233 0.539 . . . . 74.23 110.491 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 20.1 m -86.73 93.72 9.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.517 -0.765 . . . . 75.31 110.824 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -167.96 143.55 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 70.51 110.175 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.34 146.68 40.41 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.69 -0.232 . . . . 72.44 110.454 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.03 165.19 28.65 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.439 2.093 . . . . 73.12 110.847 176.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.5 mt -94.7 143.4 26.15 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-O 120.712 0.291 . . . . 72.04 110.734 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.26 127.15 9.64 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.706 2.271 . . . . 52.01 112.319 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.5 p -84.86 161.59 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.512 -0.551 . . . . 75.42 109.512 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.85 156.69 25.47 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.284 -0.265 . . . . 71.34 110.284 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -77.84 157.37 29.93 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.108 -0.496 . . . . 74.44 111.211 -178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.37 149.42 91.37 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 43.51 110.249 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.52 154.64 72.82 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 122.433 2.089 . . . . 52.44 111.789 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.5 162.02 2.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.076 0.465 . . . . 75.11 111.166 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.45 110.527 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.34 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.32 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.43 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.486 HD22 ' H ' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.02 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.15 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.42 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.3 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.44 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.1 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 65.25 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.31 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.15 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.34 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 71.43 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.32 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.13 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.406 HG13 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.31 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.45 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.43 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.516 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.14 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.34 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.42 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.03 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.51 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.24 110.336 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.501 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.53 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.02 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 73.45 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.23 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.22 109.464 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.13 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.05 112.437 -172.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.542 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 75.12 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 73.41 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.52 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.15 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.42 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.427 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.34 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.43 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.21 108.575 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.43 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.53 110.633 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.535 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.52 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.516 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.34 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.42 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.3 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.54 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.44 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.11 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.21 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.43 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.47 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.44 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.12 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.535 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 12.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.42 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 74.44 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.34 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.22 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.12 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.13 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.12 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.13 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.31 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.34 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.43 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.43 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.1 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.23 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.41 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.24 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.452 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.44 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.51 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.23 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.406 HD21 HG13 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.12 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.44 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.41 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.35 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.21 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.3 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.54 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.23 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.1 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.35 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.51 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.02 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.35 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.45 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.53 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.03 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.23 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 64.32 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.34 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -162.04 -44.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.34 111.463 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 66.5 m -154.47 125.68 7.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.897 0.38 . . . . 74.2 111.042 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -103.57 108.28 19.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.117 -0.492 . . . . 75.21 109.742 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -84.85 145.67 27.71 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.392 -0.367 . . . . 73.5 111.004 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.54 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.14 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.01 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.15 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.31 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.04 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.01 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.44 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.43 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.44 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t -165.29 -166.89 1.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.15 110.093 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.9 p -156.16 -173.06 4.34 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.698 -0.482 . . . . 74.42 109.698 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.65 -0.69 . . . . 75.01 109.905 178.787 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.385 -0.228 . . . . 75.5 110.385 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm -86.02 90.72 8.18 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.106 0.479 . . . . 55.23 110.128 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 74.4 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.42 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.21 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.1 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.664 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.53 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.664 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.22 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.21 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.41 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -70.08 90.7 0.55 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.45 113.118 -177.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.53 153.93 30.87 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 75.24 109.97 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.4 141.79 17.54 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.74 0.305 . . . . 72.43 110.9 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -92.36 121.43 66.47 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.203 -0.453 . . . . 63.33 110.988 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -70.14 -166.97 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.584 2.189 . . . . 62.5 111.153 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -156.07 175.86 13.42 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.582 0.23 . . . . 75.55 110.526 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.51 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.3 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.04 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.02 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.33 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.23 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 60.22 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.04 110.74 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m -90.66 124.05 43.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.53 110.728 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -156.82 118.93 3.89 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.108 0.48 . . . . 72.14 111.292 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.73 158.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.736 -0.665 . . . . 72.4 109.339 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.11 153.9 30.08 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 61.0 110.145 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.6 p -158.47 98.33 1.75 Allowed Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 116.28 -0.418 . . . . 74.55 111.094 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -80.82 157.36 21.08 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.593 2.196 . . . . 64.4 111.709 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.7 163.24 37.78 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 122.499 2.133 . . . . 72.24 111.854 179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.01 129.17 94.04 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.338 -0.392 . . . . 54.13 110.224 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.13 74.43 5.04 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.676 2.251 . . . . 75.12 112.564 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.5 m -85.81 125.84 40.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 116.148 -0.478 . . . . 75.34 110.506 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 18.5 p -90.42 146.79 23.88 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.145 -0.479 . . . . 70.55 110.914 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -68.45 137.85 54.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.493 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.91 162.27 28.67 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 111.035 -0.826 . . . . 72.43 111.035 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -165.84 92.14 0.51 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.843 0.354 . . . . 54.21 110.879 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.17 99.43 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.681 -0.489 . . . . 73.53 109.681 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.3 mtt -145.52 152.36 49.27 Favored Pre-proline 0 C--N 1.315 -0.899 0 N-CA-C 109.232 -0.655 . . . . 53.2 109.232 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.27 119.24 5.17 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 122.784 2.323 . . . . 73.12 111.637 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.5 m -82.34 149.14 27.9 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.876 -0.602 . . . . 74.14 110.429 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.43 HD22 ' N ' ' A' ' 46' ' ' SER . 6.4 tt -151.32 134.8 16.2 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.57 -0.9 . . . . 72.54 108.57 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.43 ' N ' HD22 ' A' ' 45' ' ' LEU . 22.4 m -71.63 89.11 0.98 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 64.45 111.242 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.2 p -101.65 -19.13 15.55 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.032 -0.531 . . . . 74.04 110.216 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.66 39.6 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.89 -0.596 . . . . 64.42 110.574 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -85.52 148.53 25.91 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.195 -0.457 . . . . 71.1 109.975 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -160.82 174.09 14.39 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.948 -0.389 . . . . 74.34 109.948 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -82.0 150.66 65.62 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 116.382 -0.372 . . . . 63.32 111.228 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.457 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 94.9 Cg_endo -81.19 166.68 18.32 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.571 2.18 . . . . 64.21 110.43 174.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.19 111.54 25.23 Favored Pre-proline 0 C--N 1.318 -0.788 0 CA-C-O 120.622 0.249 . . . . 74.5 110.401 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 97.8 Cg_endo -85.92 124.52 2.58 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.621 2.214 . . . . 75.32 111.509 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.1 m -80.59 153.34 4.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 120.859 -0.336 . . . . 74.5 111.167 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -167.15 173.61 8.94 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.365 -0.606 . . . . 75.33 109.365 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.7 m 70.93 112.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.767 0.667 . . . . 75.2 110.645 -178.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 115.96 38.5 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.899 -0.592 . . . . 73.12 111.238 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -85.19 -179.91 3.79 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.059 2.506 . . . . 73.04 111.737 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m -78.85 -176.63 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.15 109.811 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.43 110.705 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 72.12 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.31 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.3 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 64.25 110.288 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.31 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.45 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.14 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.21 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.45 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.41 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 72.1 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.34 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.54 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.01 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.44 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 74.54 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.03 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.545 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 75.44 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.54 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.53 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.43 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.545 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 44.3 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.12 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.13 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.24 111.197 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.728 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.44 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.11 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 54.21 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.43 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.44 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.52 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.665 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.04 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.665 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.01 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.42 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.12 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.55 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.54 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.41 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.45 107.809 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.49 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.53 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.42 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 54.31 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.53 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.32 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.35 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.11 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.22 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 63.43 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.427 ' HB2' HD23 ' A' ' 145' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.21 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 71.2 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.03 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 71.13 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.12 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.49 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 64.44 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.21 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.44 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 75.51 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 71.14 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.24 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 52.13 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.24 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.15 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.32 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.13 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.33 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.01 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.11 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.425 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.53 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.41 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.443 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 74.44 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.24 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 72.23 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.44 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.34 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.45 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.53 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.4 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.23 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.12 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.23 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.52 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.431 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.15 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 64.43 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.42 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.15 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 62.2 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.14 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -40.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.11 110.777 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 62.1 p -162.17 -66.04 0.05 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.916 0.389 . . . . 75.41 110.303 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -141.52 142.01 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.538 -0.541 . . . . 73.31 109.538 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.34 139.62 27.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.852 0.358 . . . . 64.24 110.553 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.45 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.23 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 74.43 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . 0.442 ' HA ' ' OE1' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.22 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.24 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.34 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.23 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.51 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.42 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.21 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m -159.52 173.92 15.43 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.41 109.148 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.9 m -156.01 147.79 23.02 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.082 -0.34 . . . . 65.13 110.082 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.556 -0.735 . . . . 74.32 110.199 179.264 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 110.124 -0.325 . . . . 74.31 110.124 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -77.23 160.41 28.94 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.863 -0.791 . . . . 74.14 108.863 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.42 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.52 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.45 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.41 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.44 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.3 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.32 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.33 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.09 102.89 0.33 Allowed 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.23 111.665 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 112.76 0.82 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.651 -0.704 . . . . 40.24 110.256 -178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.81 23.51 0.68 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.994 -0.548 . . . . 62.1 109.877 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 t -82.36 130.71 58.26 Favored Pre-proline 0 N--CA 1.438 -1.056 0 CA-C-N 116.028 -0.533 . . . . 52.32 110.219 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.66 -16.21 30.18 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.803 2.335 . . . . 70.53 111.766 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt -77.74 101.22 6.57 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.906 -0.588 . . . . 55.24 110.503 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.14 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.13 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.31 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.42 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.03 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.22 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.21 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.43 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.1 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.45 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -150.92 92.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.14 110.37 178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -89.5 157.26 18.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.669 -0.696 . . . . 75.41 111.919 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 p -161.19 116.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.636 -0.711 . . . . 73.13 110.115 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.06 149.24 17.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.203 -0.453 . . . . 63.23 109.868 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 p -152.91 108.77 2.68 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-O 120.708 0.29 . . . . 72.0 110.975 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -74.84 147.82 35.21 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 122.508 2.139 . . . . 63.54 111.819 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.44 175.33 10.23 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.61 2.207 . . . . 74.02 111.877 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.99 117.8 57.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.304 -0.407 . . . . 64.42 111.454 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -82.59 62.94 7.99 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.894 2.396 . . . . 70.43 111.588 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.63 160.87 3.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.928 -0.578 . . . . 73.11 111.205 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.9 m -149.5 133.15 16.8 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.269 -0.423 . . . . 75.0 109.888 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -116.45 168.42 10.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.165 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 161.84 136.46 2.0 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.764 -0.732 . . . . 72.14 111.905 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.33 154.65 8.77 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.804 0.335 . . . . 62.51 111.39 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.83 145.39 2.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 60.4 109.436 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 70.8 mtm -148.39 116.18 3.97 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-O 120.769 0.318 . . . . 73.43 111.102 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.24 -174.92 2.45 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 122.766 2.311 . . . . 64.34 111.618 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 t -153.23 -179.08 7.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.082 -0.34 . . . . 62.13 110.082 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.478 HD11 ' N ' ' A' ' 46' ' ' SER . 3.1 tm? -154.96 137.17 14.81 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.831 -0.803 . . . . 43.01 108.831 -178.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.478 ' N ' HD11 ' A' ' 45' ' ' LEU . 17.4 t -161.57 113.28 1.76 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.685 -0.487 . . . . 74.53 109.685 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 t -118.89 144.29 46.49 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.095 -0.502 . . . . 72.43 110.706 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.77 28.52 0.22 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.447 -0.797 . . . . 41.41 109.199 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.3 m -146.69 164.36 32.94 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.458 -0.792 . . . . 73.32 108.968 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 75.17 12.59 3.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.385 0.674 . . . . 72.13 110.399 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -85.92 117.69 69.17 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.275 -0.875 . . . . 73.03 110.128 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.478 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 34.1 Cg_exo -60.42 132.63 44.59 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.404 2.069 . . . . 72.23 111.342 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.56 103.22 17.46 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.717 -0.475 . . . . 73.41 109.717 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 4.9 Cg_exo -77.39 178.67 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.729 2.286 . . . . 72.31 112.41 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.4 t 68.59 108.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 115.424 -0.807 . . . . 60.31 111.432 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.66 21.53 0.06 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.771 -0.65 . . . . 53.1 110.605 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.1 m -156.63 123.14 5.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.284 -0.416 . . . . 72.43 110.861 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.14 126.8 92.54 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 116.1 -0.5 . . . . 73.34 110.332 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.99 177.64 8.48 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.557 2.171 . . . . 63.32 111.744 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m -84.69 172.06 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.472 -0.331 . . . . 65.14 110.198 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 74.32 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.31 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 53.21 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.14 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.2 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.22 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 43.01 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.31 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.13 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.21 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.408 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.41 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.437 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.03 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 43.04 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 45.3 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.35 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.15 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.04 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.15 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 72.11 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 71.44 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.04 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.54 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.45 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.43 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.22 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.44 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.44 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.53 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 71.42 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.43 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.55 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.22 111.461 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.581 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.13 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.581 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.24 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.23 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.42 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.4 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.32 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.42 109.274 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.24 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.1 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.484 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 64.41 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 64.14 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.44 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.32 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.34 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.11 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.21 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.428 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.01 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.34 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.486 HE21 ' NE2' ' A' ' 147' ' ' GLN . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 70.25 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.04 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.1 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.437 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.44 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.32 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.45 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.04 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.53 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.24 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.21 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.21 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.22 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.44 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.31 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.31 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.44 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.34 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 62.12 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.35 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.4 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.44 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.53 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.4 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.43 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 72.42 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.34 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.33 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 73.15 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.41 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.44 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.31 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.21 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.486 ' NE2' HE21 ' A' ' 113' ' ' GLN . 28.1 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.52 110.837 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 64.24 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 75.4 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.32 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.14 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 74.2 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 64.85 85.57 0.14 Allowed 'General case' 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.3 t 70.98 -81.96 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.043 -0.981 . . . . 64.53 112.572 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -127.79 151.36 49.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 72.31 111.381 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.9 80.94 0.71 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.866 -0.606 . . . . 72.14 110.326 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.14 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.52 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 55.41 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.11 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 74.13 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.14 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 51.43 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -73.75 160.93 30.8 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.11 109.437 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 63.5 m -157.53 152.13 25.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.89 0.376 . . . . 60.1 110.965 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.375 -0.822 . . . . 72.31 110.067 179.504 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.3 p80 . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.202 -0.296 . . . . 73.44 110.202 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -103.47 165.31 11.11 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.594 -0.521 . . . . 72.33 109.594 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.42 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.34 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.42 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.54 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 61.54 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.23 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -61.06 145.11 99.4 Favored 'Trans proline' 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.33 112.074 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.45 156.21 16.01 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.827 -0.624 . . . . 52.2 109.709 -179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.449 HD11 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -151.95 173.31 15.0 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.844 0.354 . . . . 71.14 111.519 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.0 m -82.74 119.59 74.79 Favored Pre-proline 0 N--CA 1.441 -0.885 0 N-CA-C 109.469 -0.567 . . . . 65.4 109.469 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.33 105.48 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.228 2.619 . . . . 72.5 113.102 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 16' ' ' LEU . 0.5 OUTLIER -83.29 -16.07 47.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.968 -0.56 . . . . 70.0 110.943 178.767 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 74.15 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.34 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.52 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.23 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.52 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.13 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.55 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.51 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p -90.2 105.99 16.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.22 109.318 175.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -79.89 105.52 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.279 0.561 . . . . 72.43 111.644 -176.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.3 m -112.27 138.03 42.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.663 -0.698 . . . . 63.21 109.931 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.1 t70 70.97 136.71 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.235 0.614 . . . . 73.32 111.898 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.0 p -153.59 92.37 3.17 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.946 -0.57 . . . . 75.32 110.165 178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -87.57 148.05 7.37 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.001 2.467 . . . . 64.1 112.831 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.22 144.84 42.53 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.306 2.004 . . . . 71.34 110.985 177.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.3 116.77 54.31 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.391 -0.368 . . . . 53.44 110.703 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.33 122.94 10.79 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.519 2.146 . . . . 74.32 111.016 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -141.97 138.73 30.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 110.136 -0.32 . . . . 75.22 110.136 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.7 t -145.12 143.33 30.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.487 -0.324 . . . . 71.44 110.171 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -125.9 157.23 38.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.331 -0.395 . . . . 75.45 110.188 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.23 136.76 4.05 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.773 -0.727 . . . . 34.42 112.287 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.71 126.73 1.3 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.867 -0.42 . . . . 64.33 109.867 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.04 -51.07 35.09 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.46 -0.337 . . . . 75.14 110.204 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 47.9 ttm 62.2 92.47 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 115.548 -0.751 . . . . 73.12 111.636 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.46 139.06 12.64 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.351 2.034 . . . . 73.23 112.063 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.0 t -82.6 -26.22 32.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.931 -0.396 . . . . 71.42 109.931 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.8 mt 67.75 172.55 0.27 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.539 -0.755 . . . . 75.24 111.716 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 m -76.5 145.9 38.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.905 -0.589 . . . . 63.33 110.75 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -80.67 159.42 25.32 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.582 -0.525 . . . . 74.24 109.582 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -152.2 12.61 0.57 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 111.868 0.321 . . . . 50.21 111.868 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -82.94 97.89 8.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.261 0.553 . . . . 73.22 109.805 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.17 137.59 43.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.412 -0.813 . . . . 74.55 111.137 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 pt20 -87.15 118.59 70.2 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 116.169 -0.469 . . . . 71.2 110.689 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.43 166.24 9.85 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.935 2.423 . . . . 62.42 112.308 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.56 118.43 70.01 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.192 -0.458 . . . . 73.05 110.481 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.3 116.15 3.43 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.808 2.338 . . . . 64.02 112.066 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.6 m -83.63 140.32 16.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 116.139 -0.482 . . . . 75.15 110.971 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.48 -30.66 66.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.057 -0.519 . . . . 72.34 110.444 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.8 m -157.2 148.52 21.98 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.856 -0.611 . . . . 64.12 110.03 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 147.91 97.58 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.207 -0.451 . . . . 52.22 111.021 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.22 148.14 34.05 Favored 'Trans proline' 0 C--O 1.24 0.588 0 C-N-CA 122.724 2.282 . . . . 70.3 112.567 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.24 170.54 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.087 -0.708 . . . . 70.21 109.087 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.536 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 74.42 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.34 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 74.15 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.35 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.54 110.633 -175.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.42 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 44.55 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.31 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.11 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.536 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.03 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.33 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.585 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.22 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.486 ' O ' HG22 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.12 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 55.15 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.1 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.35 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.2 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.41 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 71.33 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.01 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.41 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.03 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.24 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.54 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.03 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.34 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.576 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.42 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.32 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.446 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 2.3 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.51 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 74.45 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.24 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.464 ' CD1' HG22 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.03 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 72.13 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.41 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.45 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.468 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.31 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.31 111.345 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.33 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.33 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.464 HG22 ' CD1' ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 74.04 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.576 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.502 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.11 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.418 HD13 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.03 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.42 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.05 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.54 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.45 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.46 ' HB3' HE21 ' A' ' 144' ' ' GLN . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.05 108.419 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.418 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 62.2 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.13 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' CD2' HD11 ' A' ' 105' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 73.5 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.43 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.32 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.34 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.422 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.14 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.2 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.14 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.01 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.3 109.176 175.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.32 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.32 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.41 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.41 109.693 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.41 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.456 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.34 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.24 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.52 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 73.04 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.24 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.33 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.41 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.12 110.542 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.14 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.45 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.3 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 60.12 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.12 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.05 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.46 HE21 ' HB3' ' A' ' 111' ' ' GLN . 18.4 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.45 110.186 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.02 109.803 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.44 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.44 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.21 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.22 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.4 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.02 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.1 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 72.79 132.12 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 63.33 111.121 -179.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 31.4 m -76.73 101.42 5.79 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.953 -0.567 . . . . 61.43 110.687 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -83.7 139.87 32.49 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.396 . . . . 65.2 110.172 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.26 89.36 6.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.057 0.456 . . . . 52.2 110.355 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.12 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.53 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.05 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.44 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.23 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.22 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 62.01 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.43 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.33 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 71.31 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p -167.63 179.56 4.8 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.12 110.451 -177.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 p -159.37 178.12 10.27 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.1 -0.333 . . . . 72.13 110.1 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.585 -0.722 . . . . 75.13 110.238 179.769 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 110.314 -0.254 . . . . 75.14 110.314 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? 69.52 155.32 0.13 Allowed 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.753 0.658 . . . . 72.34 112.191 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.11 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 45.5 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.24 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 72.54 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.2 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 61.34 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.41 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.78 155.92 61.65 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.43 111.672 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.36 112.81 12.04 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.189 -0.46 . . . . 75.25 110.971 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.09 150.02 25.83 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 110.12 -0.326 . . . . 71.15 110.12 177.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 p -87.56 155.19 53.86 Favored Pre-proline 0 C--N 1.31 -1.151 0 CA-C-N 116.223 -0.444 . . . . 74.4 109.914 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -58.14 119.58 6.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 C-N-CA 122.445 2.097 . . . . 62.2 111.294 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.57 145.65 48.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.613 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 74.32 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.33 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.23 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.13 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.21 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.02 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.14 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 74.2 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 60.14 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.544 ' HZ2' ' HB3' ' A' ' 26' ' ' LYS . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.13 110.884 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.42 159.67 2.86 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.22 108.55 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -153.03 115.3 4.4 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 119.415 -0.914 . . . . 63.22 112.505 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -151.66 97.74 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 114.951 -1.022 . . . . 74.43 109.281 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -148.76 133.06 17.47 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.771 -0.65 . . . . 73.11 109.922 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.1 p -157.05 137.19 8.82 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 116.009 -0.541 . . . . 61.13 110.31 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.91 123.75 13.9 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.553 2.168 . . . . 54.4 111.578 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.74 118.87 4.86 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.029 2.486 . . . . 54.4 112.161 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.34 129.74 88.58 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.769 -0.651 . . . . 61.54 110.844 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 179.58 4.68 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.597 2.198 . . . . 74.24 112.196 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.53 114.26 22.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.49 0.662 . . . . 75.54 110.815 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 15.2 t -89.78 -19.93 24.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.972 -0.558 . . . . 53.25 110.33 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -71.55 128.82 37.09 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.205 -0.452 . . . . 73.15 110.046 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.07 -171.79 43.33 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.712 -0.756 . . . . 71.11 112.882 -178.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.62 -168.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.489 -0.56 . . . . 64.41 109.489 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.76 -169.19 2.0 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.104 -0.332 . . . . 74.44 110.104 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.1 tpt -139.09 102.16 7.55 Favored Pre-proline 0 C--N 1.317 -0.839 0 CA-C-O 120.824 0.345 . . . . 74.12 110.822 -178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.53 111.07 3.23 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.759 2.306 . . . . 74.54 111.061 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.8 t -151.28 152.7 33.59 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.287 -0.415 . . . . 72.33 110.22 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 tp -159.68 166.24 30.99 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.743 -0.836 . . . . 73.53 108.743 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.7 m -157.89 88.36 0.97 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 73.11 110.119 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 p -113.04 152.15 29.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.625 -0.716 . . . . 74.42 110.02 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -157.22 92.32 1.24 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.441 0.638 . . . . 64.13 110.383 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.2 m -151.47 98.43 2.51 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.581 -0.736 . . . . 74.04 110.227 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.2 174.65 9.18 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.707 -0.679 . . . . 71.35 110.088 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -77.81 114.82 44.91 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 109.946 -0.391 . . . . 64.02 109.946 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.36 106.0 0.79 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.539 2.159 . . . . 75.4 111.229 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.3 mt -114.34 105.53 53.78 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.254 -0.43 . . . . 71.42 110.639 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.72 146.94 27.21 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.421 2.08 . . . . 72.42 111.216 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.5 m -80.36 81.97 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.783 0.801 . . . . 75.41 110.573 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.92 165.41 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.155 -0.929 . . . . 23.04 109.583 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.6 m -75.9 165.31 25.18 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.354 -0.384 . . . . 71.22 110.574 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.59 133.62 94.26 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.165 -0.47 . . . . 74.34 110.88 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -84.64 164.07 12.31 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.711 2.274 . . . . 74.24 111.898 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m -91.41 164.75 2.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.506 -0.553 . . . . 44.12 109.506 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.42 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.04 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.14 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.04 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.44 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 74.02 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.449 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.32 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 73.44 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.55 111.143 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.12 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 74.2 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 75.53 109.135 176.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.13 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.14 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.52 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 70.41 110.879 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.474 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 64.44 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.52 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.14 111.484 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.45 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.41 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.2 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.44 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.04 109.713 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.3 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 65.45 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 102' ' ' HIS . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.15 112.842 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.42 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.44 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.2 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.45 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.473 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.473 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.33 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.443 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 71.01 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.03 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.21 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.41 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.404 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 1.1 m80 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.41 110.222 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 75.45 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.483 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 71.4 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.13 110.91 -177.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.44 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.44 111.063 -172.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.53 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.12 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.41 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.442 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.21 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.51 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.483 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.3 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.43 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 72.32 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.803 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 71.13 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.02 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.23 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.416 ' OG ' HG23 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.41 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.24 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.416 HG23 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.23 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.444 ' HA ' ' NE ' ' A' ' 124' ' ' ARG . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.41 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.12 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 64.4 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.21 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.34 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.61 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.33 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.4 112.587 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.11 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.61 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 65.31 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.42 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 135' ' ' ARG . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.54 111.745 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 72.4 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.02 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.22 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.42 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.44 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.41 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.15 110.768 -179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.14 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 71.43 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.41 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.43 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.23 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.34 109.529 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.403 HG23 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.43 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.11 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.51 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 174.32 -31.34 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.21 106.384 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.2 m -158.84 165.02 35.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 113.766 -1.561 . . . . 54.11 106.91 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -125.02 141.26 52.24 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.97 -0.692 . . . . 64.3 111.588 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.61 158.38 33.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.342 -0.844 . . . . 74.23 109.573 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.33 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 65.1 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.52 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.42 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.13 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.42 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 75.13 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.04 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.12 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m -162.58 135.88 5.99 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 41.14 109.983 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 m -157.87 163.41 37.97 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.476 -0.564 . . . . 61.4 109.476 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.313 -1.003 0 CA-C-O 118.545 -0.74 . . . . 73.43 110.242 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 110.234 -0.284 . . . . 73.15 110.234 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt -99.29 32.77 2.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.04 0.447 . . . . 62.24 110.662 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.21 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 72.25 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.12 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.457 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.32 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.457 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.42 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.41 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 75.44 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.12 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.71 -168.73 0.51 Allowed 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.51 111.954 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.77 149.93 11.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.872 -0.604 . . . . 72.13 109.391 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.3 pt? -156.64 153.5 28.66 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.078 -0.342 . . . . 74.23 110.078 -178.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.9 t -85.99 133.51 41.02 Favored Pre-proline 0 C--N 1.307 -1.248 0 CA-C-N 116.551 -0.295 . . . . 75.01 110.289 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.31 132.41 41.09 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.372 2.048 . . . . 74.32 111.047 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -77.31 84.96 3.75 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.872 0.367 . . . . 63.33 111.091 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.2 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 75.22 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.15 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.55 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.32 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.11 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.53 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.13 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.44 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.42 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -150.58 103.33 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.12 109.891 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -82.41 100.23 9.89 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.697 -0.683 . . . . 75.21 110.594 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.5 p -125.06 141.92 43.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.982 -0.554 . . . . 72.01 110.37 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -155.1 -23.06 0.12 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.07 0.462 . . . . 62.25 110.675 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -146.81 85.68 6.98 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.048 0.452 . . . . 72.31 110.425 178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -81.36 165.53 18.64 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.093 2.529 . . . . 74.11 112.113 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -67.11 140.52 54.31 Favored 'Trans proline' 0 C--O 1.241 0.651 0 C-N-CA 122.622 2.214 . . . . 65.13 112.387 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.38 149.08 98.17 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.821 -0.627 . . . . 63.34 110.86 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.51 51.5 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.063 2.509 . . . . 53.15 112.648 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.8 m -84.17 136.07 23.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 116.112 -0.494 . . . . 72.0 110.656 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.7 m 56.05 79.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.382 0.611 . . . . 73.32 110.685 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -112.34 109.86 19.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.961 -0.563 . . . . 75.51 111.205 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.96 141.25 15.21 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.935 -0.65 . . . . 75.0 111.601 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.78 172.5 8.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.799 0.333 . . . . 75.43 111.055 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.62 140.38 9.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.199 -0.455 . . . . 75.51 110.396 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 24.0 ptp -157.07 144.06 13.53 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.88 -0.6 . . . . 64.43 109.882 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.94 117.41 4.91 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.43 2.087 . . . . 73.53 111.724 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -87.62 -31.53 19.77 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.133 0.492 . . . . 72.43 110.648 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.97 -164.6 0.9 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.619 -0.719 . . . . 73.25 110.549 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.3 m 71.47 26.31 3.26 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.094 0.558 . . . . 72.04 111.797 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.9 t -125.09 101.46 7.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.078 0.466 . . . . 62.45 110.643 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.37 -27.7 46.96 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.994 -0.548 . . . . 71.24 109.846 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.1 m 55.62 69.29 0.75 Allowed 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.48 -0.782 . . . . 73.41 110.846 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.1 151.81 10.48 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.48 -0.782 . . . . 72.22 109.963 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -81.53 138.04 47.93 Favored Pre-proline 0 C--N 1.311 -1.086 0 CA-C-N 116.465 -0.334 . . . . 74.31 110.265 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -61.1 105.78 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.343 2.029 . . . . 74.12 111.064 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.466 ' O ' HD12 ' A' ' 53' ' ' LEU . 3.8 pp -76.35 138.43 67.78 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.181 -0.463 . . . . 54.41 111.417 -178.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.21 175.56 9.76 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.467 2.112 . . . . 73.05 111.78 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -140.14 173.32 10.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.977 -0.556 . . . . 74.12 109.835 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.08 -171.66 2.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.681 0.276 . . . . 64.31 110.777 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 t -73.26 158.94 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.88 -0.6 . . . . 70.12 109.77 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.35 125.9 91.77 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.297 -0.411 . . . . 61.43 111.56 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.05 -179.36 4.92 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 123.198 2.598 . . . . 70.24 111.333 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m -75.83 154.09 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.14 111.182 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.31 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.15 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.53 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.4 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.05 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.13 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.42 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.53 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 72.02 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.11 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.12 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 73.44 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 79' ' ' MET . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.22 111.03 177.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.03 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.41 112.491 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.13 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.502 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.21 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.12 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.32 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 74.21 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.55 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.42 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 64.2 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.24 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.34 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.24 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.1 110.125 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.492 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.15 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.32 112.488 -175.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.634 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 39.0 m80 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.634 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.41 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.34 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.12 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.13 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.55 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.34 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.33 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.53 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.13 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.47 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.01 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.463 HD13 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.14 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.54 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.23 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.32 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.04 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.44 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.02 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.463 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.1 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.558 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.43 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.02 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.47 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.41 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.458 ' SD ' HD13 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.42 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.33 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.12 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.15 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.15 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.51 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 75.1 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.33 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 65.43 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 43.13 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.13 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.458 HD13 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.02 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.15 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.559 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.2 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 74.25 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.02 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.559 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.2 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.55 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.23 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.11 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.35 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.13 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.44 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.35 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.04 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.22 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.41 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.22 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.14 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.33 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.558 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.03 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 72.44 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 64.41 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.1 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.12 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.12 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -160.33 -42.88 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.03 109.607 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 32.3 p -155.86 166.08 34.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.65 -0.705 . . . . 73.42 109.235 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -82.51 117.83 22.81 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.83 0.347 . . . . 74.32 110.674 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.95 110.41 17.19 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.101 -0.5 . . . . 51.4 110.706 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.51 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.03 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.21 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.31 111.323 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.15 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 74.21 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.33 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.52 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.2 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.24 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m -160.18 17.99 0.15 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.52 110.476 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 61.8 p -164.52 160.29 20.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.447 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 . . . . . 0 C--N 1.316 -0.864 0 CA-C-O 118.431 -0.795 . . . . 71.32 109.756 177.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 50.4 m80 . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.901 0.381 . . . . 73.21 110.657 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -131.58 151.45 51.59 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.211 -0.45 . . . . 74.31 109.975 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.05 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.34 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.23 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.21 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.32 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.52 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 72.55 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.15 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -83.17 -161.43 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.12 111.505 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.48 149.24 15.08 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.337 -0.392 . . . . 75.33 110.075 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.6 mt -150.23 141.48 23.2 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.107 -0.497 . . . . 74.33 109.971 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 p -86.38 143.06 35.96 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.933 -0.576 . . . . 72.32 110.714 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.31 112.68 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.552 2.168 . . . . 74.52 111.368 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -151.0 103.99 3.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.015 0.436 . . . . 71.01 110.705 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 73.0 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.34 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.01 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.42 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.22 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.11 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.43 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.41 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.42 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.12 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.43 113.88 29.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.31 110.754 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -158.18 109.57 2.22 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.926 -0.579 . . . . 72.32 109.716 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -114.65 170.7 4.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 116.356 -0.384 . . . . 74.4 111.305 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -161.01 102.91 1.29 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.689 -0.687 . . . . 65.52 109.356 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -83.11 118.7 72.47 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.999 -0.546 . . . . 73.15 111.591 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -85.25 132.19 4.38 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.592 2.194 . . . . 75.24 111.949 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.44 130.91 35.69 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.493 2.129 . . . . 73.15 111.67 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.47 121.08 83.89 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.511 . . . . 74.23 111.123 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.82 170.05 20.57 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.523 2.149 . . . . 71.15 111.932 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.8 p -88.59 130.92 37.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.266 -0.424 . . . . 71.23 110.406 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.7 t -87.69 147.86 25.04 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.432 -0.349 . . . . 72.21 110.431 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 -120.73 169.12 10.7 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.373 -0.376 . . . . 75.04 110.207 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 137.65 128.1 2.62 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.38 -0.914 . . . . 61.24 112.556 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 139.37 4.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.956 -0.387 . . . . 53.15 109.956 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.66 161.5 18.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.835 0.35 . . . . 75.43 111.153 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.9 tpt -159.5 85.57 2.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.779 -0.646 . . . . 75.45 109.306 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -76.99 119.53 5.12 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.805 2.337 . . . . 71.01 112.885 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 t -157.92 113.48 2.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.51 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -154.99 119.33 4.71 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.206 -0.452 . . . . 72.11 111.112 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 m 67.24 161.5 0.17 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.963 0.727 . . . . 74.35 112.963 176.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -98.35 -37.77 9.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.724 -0.671 . . . . 73.25 109.272 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 69.92 132.91 0.03 OUTLIER 'General case' 0 C--N 1.35 0.609 0 C-N-CA 124.008 0.923 . . . . 70.2 112.027 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.7 m -85.02 99.12 10.81 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.104 0.478 . . . . 72.4 110.082 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.12 -20.24 59.52 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.798 -0.637 . . . . 74.34 111.167 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -79.57 126.21 81.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.198 -0.456 . . . . 74.3 110.927 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.37 166.89 28.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.921 2.414 . . . . 63.44 111.654 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 74.6 mt -112.37 101.54 52.48 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-O 120.89 0.376 . . . . 75.41 110.543 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -88.66 -149.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.184 2.589 . . . . 71.44 111.812 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -150.39 93.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.738 0.78 . . . . 75.01 110.161 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.89 116.59 10.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.258 -0.883 . . . . 73.24 111.198 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.2 m 60.24 79.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.504 -0.771 . . . . 71.12 111.948 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.89 131.35 81.71 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.886 -0.597 . . . . 44.52 110.47 178.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.23 178.9 7.07 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.765 2.31 . . . . 61.42 111.517 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.88 166.38 2.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 121.001 0.429 . . . . 73.41 110.317 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.54 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 60.23 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.24 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.51 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 74.54 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.54 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.23 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.474 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.2 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.42 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.43 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.54 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.22 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 63.14 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.2 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.24 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.23 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 63.24 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.24 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.52 111.161 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.14 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.446 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.34 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.42 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.3 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 55.43 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 73.14 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.11 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.23 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.478 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.41 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 62.31 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.34 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.515 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.33 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.52 111.901 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 75.35 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.14 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.04 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.463 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.41 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.01 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.12 110.372 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.435 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.33 110.933 176.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.52 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.13 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 73.24 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 74.43 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.24 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.03 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 75.22 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.34 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.14 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.24 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.52 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.51 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB3' HD22 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.41 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.12 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.05 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.12 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.1 108.695 -176.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 71.21 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 64.24 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.52 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 70.33 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.41 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.51 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.03 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.41 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.54 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.35 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.21 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.05 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.466 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.12 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.52 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.466 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.35 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.466 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 64.43 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 73.12 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.435 ' CB ' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.44 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.406 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 14.1 mm100 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.33 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.23 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.23 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.42 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.33 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.52 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.12 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.23 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.01 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 17.4 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.44 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' SER . . . . . 0.428 ' HG ' ' C ' ' A' ' 147' ' ' GLN . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.03 110.384 -177.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.02 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.34 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.13 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.22 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -165.69 -37.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.955 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 22.7 t -150.29 -163.91 1.89 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.144 -0.687 . . . . 74.12 109.144 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -78.42 145.31 35.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.639 -0.504 . . . . 63.4 109.639 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.06 139.04 14.39 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.816 0.341 . . . . 75.32 110.771 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.11 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.1 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.12 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.41 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 63.13 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.41 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.41 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.42 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p -167.07 155.58 9.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.41 111.52 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 50.5 m -157.8 170.67 21.84 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.223 -0.658 . . . . 64.12 109.223 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.347 -0.835 . . . . 73.22 110.035 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 120.654 0.264 . . . . 75.45 110.756 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp -75.46 114.26 13.8 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.193 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.45 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 64.24 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.33 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.44 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.22 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.31 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 73.24 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.4 112.537 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -92.13 166.72 3.05 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.45 112.098 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.92 165.7 24.44 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.855 -0.612 . . . . 65.33 111.058 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.03 156.51 29.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.223 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.1 p -84.05 152.12 61.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 116.541 -0.3 . . . . 75.53 110.582 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -61.8 125.1 15.84 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.624 2.216 . . . . 73.41 111.797 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.05 110.59 9.48 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.345 -0.389 . . . . 71.52 110.519 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.15 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.12 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.44 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.1 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.21 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.51 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.11 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.54 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.51 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p -152.54 147.0 15.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.53 110.434 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -156.39 106.23 2.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.238 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -138.51 109.85 5.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.402 0.62 . . . . 73.43 111.343 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -162.68 158.86 23.67 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 72.13 109.709 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 23.2 t -156.9 121.52 2.35 Favored Pre-proline 0 C--N 1.317 -0.835 0 N-CA-C 109.944 -0.391 . . . . 64.35 109.944 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 31' ' ' SER . 26.5 Cg_exo -64.02 115.42 3.11 Favored 'Trans proline' 0 C--O 1.24 0.582 0 C-N-CA 123.005 2.47 . . . . 72.01 112.195 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.97 124.37 2.14 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.534 2.156 . . . . 75.54 111.964 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.54 120.07 79.23 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.183 -0.462 . . . . 54.14 110.835 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.37 118.08 5.46 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.495 2.13 . . . . 53.43 112.136 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.1 -18.64 8.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.243 -0.435 . . . . 74.01 110.939 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 p -87.81 117.62 26.77 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.059 -0.519 . . . . 72.41 110.489 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.4 m80 -126.41 110.01 12.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.792 0.329 . . . . 74.41 110.696 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -129.77 72.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.478 -0.649 . . . . 55.21 111.478 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.48 -175.48 3.9 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.634 -0.506 . . . . 74.01 109.634 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 52.8 68.91 0.76 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.303 0.573 . . . . 51.42 111.007 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.9 mtm -144.62 117.77 5.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.867 -0.606 . . . . 73.15 110.176 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -78.76 155.82 27.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.73 2.287 . . . . 74.31 112.338 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.5 t -160.8 146.94 14.93 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 116.11 -0.495 . . . . 74.55 110.189 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt 62.03 -166.58 0.21 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.144 0.578 . . . . 72.15 111.848 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.7 t -165.55 102.69 0.71 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.01 -0.541 . . . . 75.11 109.634 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.2 m -116.73 162.74 17.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.273 -0.421 . . . . 75.21 110.891 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.99 149.76 14.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.895 -0.593 . . . . 74.03 109.853 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.86 106.09 3.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.979 0.419 . . . . 61.11 111.388 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.63 88.38 0.41 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 74.03 109.57 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -85.51 114.29 55.65 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.65 -0.704 . . . . 65.24 111.822 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.91 107.01 1.98 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.434 2.09 . . . . 74.15 110.748 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.4 mt -101.39 121.26 52.25 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.33 -0.396 . . . . 64.21 111.283 -177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.57 159.12 16.77 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.571 2.181 . . . . 62.02 111.395 177.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t 72.68 143.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.147 0.579 . . . . 74.32 111.342 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -162.72 138.33 7.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.278 -0.419 . . . . 71.33 110.724 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.429 ' O ' ' HD3' ' A' ' 59' ' ' PRO . 48.4 t -161.73 147.29 13.52 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.627 -0.879 . . . . 61.22 108.627 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.54 112.53 15.33 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 120.766 0.317 . . . . 75.34 111.061 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 57' ' ' SER . 58.3 Cg_endo -101.34 176.6 0.23 Allowed 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 123.281 2.654 . . . . 72.12 111.535 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.27 149.68 3.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 109.002 -0.74 . . . . 61.51 109.002 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 53.42 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.13 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.53 110.76 176.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.43 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.23 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.41 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.33 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.04 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.01 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.44 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.527 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.1 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.672 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.2 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.509 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.14 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.4 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.12 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.13 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.648 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.13 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.43 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.419 ' CE1' ' HB1' ' A' ' 89' ' ' ALA . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.44 111.757 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.23 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 75.15 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.41 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.513 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.21 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 75.55 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.419 ' HB1' ' CE1' ' A' ' 81' ' ' PHE . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 50.35 111.214 -178.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.42 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.13 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.51 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.02 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.497 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.4 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.497 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.23 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.04 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.34 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 50.23 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.24 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.55 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.2 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 61.25 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.495 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.43 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.53 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.14 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.11 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.42 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.23 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.12 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.13 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.657 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.53 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.51 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.1 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.13 111.519 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.495 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.11 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.43 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.493 HG11 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.44 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.22 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.14 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.23 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.44 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.33 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.424 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.52 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.35 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 53.5 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.45 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.42 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.44 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.41 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.407 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.24 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.51 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.42 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.41 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 75.21 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.14 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.03 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.34 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 75.24 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.52 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.03 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.15 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.41 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.559 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 65.14 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.32 110.044 178.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.41 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.442 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.52 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.23 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 64.15 112.265 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.15 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.493 ' H ' HG11 ' A' ' 117' ' ' VAL . 37.2 mt-10 67.16 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.24 111.647 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 23.3 t -96.57 164.61 12.53 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.278 -0.638 . . . . 73.32 109.278 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -78.52 124.89 28.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.951 -0.389 . . . . 73.13 109.951 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.98 121.97 26.69 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.304 -0.407 . . . . 63.35 110.768 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.05 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.43 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.24 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.35 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.13 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 72.02 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.35 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.41 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.13 109.654 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 74.21 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m -159.58 164.4 34.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 22.8 t -162.03 -169.39 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.859 -0.423 . . . . 72.02 109.859 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.567 -0.73 . . . . 63.11 110.197 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.4 m80 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 109.935 -0.395 . . . . 75.24 109.935 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm -157.79 157.3 33.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.82 0.343 . . . . 55.1 111.195 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 74.14 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.41 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 61.51 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.13 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.493 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.1 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.493 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.33 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.3 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.34 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.43 147.24 58.11 Favored 'Trans proline' 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.12 111.031 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.88 121.14 18.52 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.455 -0.339 . . . . 63.13 110.451 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.9 124.52 28.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.874 0.369 . . . . 62.14 110.355 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.2 m -81.33 123.61 81.2 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 73.15 110.349 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 176.98 7.43 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.804 2.336 . . . . 74.4 111.982 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.51 169.61 23.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.228 -0.442 . . . . 64.22 110.312 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 71.13 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.53 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.04 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.4 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.23 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.22 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.41 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.43 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.41 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -146.28 133.21 14.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 64.25 108.187 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -151.61 27.67 0.64 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.984 0.421 . . . . 64.3 110.777 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.8 m -131.32 161.59 40.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.895 -0.593 . . . . 75.21 110.751 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.75 -170.81 3.31 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.858 -0.61 . . . . 73.41 109.462 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -79.02 145.76 66.28 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-O 120.7 0.286 . . . . 74.31 110.909 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.61 165.48 18.01 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.766 2.31 . . . . 62.42 111.236 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -49.51 114.1 1.2 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.735 2.29 . . . . 72.33 112.243 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.61 124.18 90.46 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.202 -0.453 . . . . 54.23 110.637 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -60.36 109.23 0.6 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.436 2.09 . . . . 73.54 111.629 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.6 m -86.02 148.96 4.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.604 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 34.6 p -87.88 -38.72 15.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.37 -0.377 . . . . 73.0 111.127 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -126.39 149.36 49.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.347 -0.388 . . . . 72.22 111.14 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.36 -78.14 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 111.441 -0.664 . . . . 75.52 111.441 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 18.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.78 0.324 . . . . 72.44 111.178 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.12 -24.55 59.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.998 0.428 . . . . 74.44 111.082 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -153.8 161.11 30.02 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 109.26 -0.645 . . . . 55.33 109.26 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -46.51 -57.25 2.36 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.808 2.339 . . . . 63.1 112.486 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.522 HG22 ' H ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER 63.58 178.18 0.16 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 116.097 -0.501 . . . . 75.22 110.62 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.522 ' H ' HG22 ' A' ' 44' ' ' THR . 61.0 tp -75.96 151.14 37.33 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.654 -0.499 . . . . 64.1 109.654 177.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t 71.74 -167.13 0.14 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 123.638 0.586 . . . . 72.4 109.769 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 m 67.85 113.76 0.04 OUTLIER 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.083 0.553 . . . . 75.53 110.968 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.78 -161.48 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.208 -0.451 . . . . 54.31 110.689 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.6 m 74.29 -57.31 0.62 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.618 0.767 . . . . 74.4 111.492 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.5 74.43 4.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.991 0.424 . . . . 53.33 110.124 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -90.38 140.91 27.07 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 75.32 110.6 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.62 105.31 0.75 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.945 1.764 . . . . 72.03 110.018 175.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.8 mt -91.07 141.35 26.37 Favored Pre-proline 0 C--N 1.312 -1.044 0 CA-C-N 116.432 -0.349 . . . . 64.11 111.686 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.35 173.45 14.48 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.798 2.332 . . . . 70.12 111.474 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.4 m -82.8 160.35 3.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 120.734 0.302 . . . . 63.15 110.813 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.16 -165.09 0.36 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.998 -0.546 . . . . 65.54 110.324 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.1 t -72.49 169.75 15.78 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.258 -0.645 . . . . 72.21 109.258 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.38 129.16 92.22 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-O 120.376 0.131 . . . . 73.23 110.913 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.68 125.51 18.18 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.018 2.479 . . . . 54.14 112.612 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -87.25 163.48 2.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.605 -0.725 . . . . 75.11 110.503 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 75.23 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 74.14 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 65.45 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.24 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.34 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.01 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 75.04 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.41 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.447 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.14 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.13 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.11 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 75.12 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.14 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.22 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.11 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.14 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.43 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.43 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.51 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.51 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.43 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.55 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.44 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.21 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.542 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 48.6 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.01 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.32 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 44.21 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.15 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.1 mp0 -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.05 109.038 175.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.22 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.52 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 72.21 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.3 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.23 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.33 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.42 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.446 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.53 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.21 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.43 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 74.34 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.13 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.22 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.3 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.555 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.15 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.24 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.12 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.552 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.12 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.41 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.552 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.42 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.15 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.4 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.41 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.458 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.53 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.48 HG11 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 75.34 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.34 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 72.11 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.23 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.51 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.45 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 74.11 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.458 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.41 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.13 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.32 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.52 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.438 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.51 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 74.15 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.563 ' O ' HG23 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.04 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 73.42 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.21 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.563 HG23 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.24 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.11 110.06 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.403 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.44 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 75.33 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.23 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.403 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.32 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.24 110.124 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.34 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.15 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.33 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.03 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 116' ' ' MET . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.21 109.185 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.428 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.33 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.48 ' H ' HG11 ' A' ' 117' ' ' VAL . 42.3 mt-10 69.97 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.23 109.519 -176.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 52.2 m -156.43 25.47 0.35 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.112 -0.699 . . . . 64.02 109.112 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -78.75 110.76 14.21 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.37 -0.832 . . . . 74.51 111.624 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.61 98.09 11.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.842 -0.617 . . . . 73.23 110.051 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.13 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.41 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.33 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 72.05 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.14 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 74.21 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.23 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.14 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.04 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.01 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m -157.71 114.15 2.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 71.54 110.821 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -161.74 129.61 4.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.449 -0.796 . . . . 50.2 110.299 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.457 -0.782 . . . . 70.13 110.246 179.296 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 t60 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.834 0.349 . . . . 75.2 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -89.98 -162.82 0.93 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.209 -0.45 . . . . 65.1 110.118 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.13 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.44 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.31 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.12 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.1 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.41 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.04 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -83.31 173.01 10.12 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 43.34 111.852 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 133.07 2.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.471 -0.331 . . . . 73.1 110.854 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 85.3 mt -82.68 141.13 32.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.415 -0.357 . . . . 75.11 110.046 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.3 m -86.63 119.43 71.32 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 116.549 -0.296 . . . . 61.52 110.798 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.71 143.67 18.93 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.361 2.041 . . . . 63.12 110.974 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.84 154.1 23.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.758 0.313 . . . . 72.34 110.448 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.01 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.31 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.41 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.33 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.53 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' C ' ' HG1' ' A' ' 23' ' ' THR . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.21 110.799 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.44 ' HG1' ' C ' ' A' ' 22' ' ' ALA . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.12 109.231 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.44 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.23 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m -84.51 144.76 9.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 71.14 111.044 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -149.17 90.06 1.71 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.075 -0.511 . . . . 75.23 110.792 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.4 p -113.55 -2.23 10.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.261 0.553 . . . . 75.22 109.614 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 70.34 154.97 0.13 Allowed 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.066 -0.97 . . . . 74.02 111.32 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t 71.65 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.541 -0.754 . . . . 72.54 111.065 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.37 159.04 44.01 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.858 2.372 . . . . 74.52 111.726 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -58.14 126.05 20.39 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.688 2.259 . . . . 63.52 112.101 179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -69.57 129.73 91.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 53.55 110.675 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 28.9 Cg_exo -62.59 140.44 81.31 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.655 2.237 . . . . 62.24 112.274 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.7 t -140.73 133.3 31.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.948 -0.76 . . . . 53.45 108.948 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.1 m -88.67 134.51 33.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.488 -0.324 . . . . 75.32 111.113 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -64.98 156.39 31.42 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.249 -0.432 . . . . 71.52 110.636 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.75 -119.71 4.51 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.962 -0.637 . . . . 50.54 111.521 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.5 -68.24 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 122.264 0.226 . . . . 71.4 110.402 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 46.82 68.75 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.732 0.645 . . . . 75.52 111.416 -178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mtp -150.87 99.81 3.1 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.982 -0.554 . . . . 73.5 110.603 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -63.48 97.05 0.2 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.266 1.978 . . . . 64.13 110.009 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 m -89.31 124.62 34.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.827 -0.624 . . . . 71.44 111.883 -175.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 62.7 tp -82.89 140.09 33.05 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.084 -0.71 . . . . 75.13 109.084 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m -70.45 83.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.36 0.6 . . . . 65.33 110.743 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.3 t -154.48 113.79 3.71 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.302 -0.863 . . . . 73.35 109.302 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.07 152.6 19.23 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.79 -0.641 . . . . 74.14 109.829 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 2.0 t -148.14 96.19 2.59 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.682 0.753 . . . . 72.45 110.259 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.42 175.98 9.46 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.065 -0.97 . . . . 75.22 108.825 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.55 117.78 69.39 Favored Pre-proline 0 C--N 1.311 -1.082 0 C-N-CA 120.886 -0.325 . . . . 75.0 110.187 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.67 126.96 13.3 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.272 2.648 . . . . 74.24 112.21 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.7 mt -96.37 114.09 63.7 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 115.89 -0.596 . . . . 75.54 110.677 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.52 147.93 92.8 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.357 2.038 . . . . 71.12 110.724 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.424 ' O ' HD13 ' A' ' 80' ' ' LEU . 14.2 m -143.23 132.75 21.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.944 0.402 . . . . 75.43 110.891 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -45.6 58.07 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.744 -0.662 . . . . 63.35 110.321 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.2 m -80.2 104.25 10.63 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.816 -0.629 . . . . 73.1 110.862 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 124.34 90.74 Favored Pre-proline 0 C--O 1.239 0.521 0 CA-C-N 115.899 -0.592 . . . . 62.01 110.813 179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.13 177.11 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.418 2.079 . . . . 74.01 111.624 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m -86.14 159.82 3.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.301 -0.409 . . . . 64.1 109.991 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.34 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.44 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.22 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.21 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.512 HD22 ' H ' ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 74.22 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 71.31 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.12 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.42 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.33 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.53 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.35 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.658 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.13 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.53 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.11 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.1 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.483 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.12 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.421 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.54 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 55' ' ' VAL . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.42 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.14 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.05 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.424 ' HD3' HD11 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.32 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.15 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.31 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 72.1 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.1 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.4 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.4 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.22 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.42 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.04 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.417 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.24 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.417 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.42 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.01 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.497 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.14 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.497 ' H ' ' HG3' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.14 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.03 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.11 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 62.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 75.23 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.54 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.472 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 74.33 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.428 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 64.25 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.34 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.35 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.52 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 73.01 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.44 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.13 109.354 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.4 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.23 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 74.42 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.53 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.623 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.22 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.1 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.52 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.43 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.44 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.04 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.41 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.03 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.22 110.347 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.02 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 73.24 111.972 177.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.03 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.1 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.23 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 70.22 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.11 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.4 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.21 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.04 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.11 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.04 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.52 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 74.32 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.24 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.489 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.34 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.21 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.41 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.12 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.52 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.43 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.623 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.43 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -143.06 -46.24 0.3 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.14 108.293 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.9 t -160.96 134.85 6.88 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.253 -1.017 . . . . 75.42 108.253 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -90.2 103.41 16.09 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.818 0.342 . . . . 75.33 110.162 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.88 113.61 2.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.052 -0.522 . . . . 73.53 110.206 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.54 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 61.52 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.32 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.01 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.23 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.4 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.53 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 72.53 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.44 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.35 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p -168.12 140.91 3.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 73.41 110.5 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.4 m -156.24 -19.07 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.37 -0.377 . . . . 71.12 111.133 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.84 -0.6 . . . . 75.4 110.043 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.861 0.362 . . . . 73.03 110.917 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt -75.96 167.39 21.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.159 -0.473 . . . . 74.43 109.921 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.31 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.33 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.24 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.23 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.34 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.34 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -83.94 139.8 8.68 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.34 112.694 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.83 155.1 37.92 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.792 -0.64 . . . . 70.41 109.466 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -147.7 97.77 2.87 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.253 0.549 . . . . 74.22 109.763 -178.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 40.4 m -85.89 130.4 50.66 Favored Pre-proline 0 C--N 1.313 -0.98 0 CA-C-N 115.34 -0.845 . . . . 71.0 109.332 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -56.65 121.64 10.4 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.735 2.29 . . . . 74.41 112.009 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp -76.37 131.43 39.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.038 -0.528 . . . . 63.11 110.996 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 72.25 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.45 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 75.14 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.52 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.31 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.33 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.13 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 62.32 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 70.33 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p -156.21 90.45 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.33 109.877 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -159.9 94.9 1.15 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.643 -0.708 . . . . 71.4 109.957 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.9 m -94.67 142.43 13.49 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 115.986 -0.552 . . . . 62.0 111.139 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.17 121.8 24.82 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.865 -0.607 . . . . 55.41 109.895 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 p -151.79 101.51 2.88 Favored Pre-proline 0 C--N 1.313 -1.014 0 CA-C-O 121.051 0.453 . . . . 41.14 111.049 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -85.44 154.13 10.59 Favored 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.801 2.334 . . . . 74.34 111.705 178.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.49 140.81 30.52 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.371 2.048 . . . . 74.3 111.586 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.21 126.15 89.36 Favored Pre-proline 0 C--N 1.316 -0.854 0 CA-C-N 116.08 -0.509 . . . . 73.15 110.211 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.03 122.23 10.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.709 2.273 . . . . 44.3 111.091 178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.1 t 62.31 80.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.816 -0.629 . . . . 73.31 109.91 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 t -83.15 -19.94 35.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.986 -0.552 . . . . 72.12 110.404 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -125.46 111.02 14.61 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.539 -0.541 . . . . 75.34 109.539 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.23 102.34 0.83 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.669 -0.777 . . . . 53.1 111.791 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.1 13.73 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.857 0.361 . . . . 71.11 110.495 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -164.26 163.37 22.71 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.82 -0.807 . . . . 52.3 108.82 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -154.79 134.34 7.77 Favored Pre-proline 0 C--N 1.311 -1.101 0 C-N-CA 120.774 -0.37 . . . . 74.3 110.982 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -64.05 108.32 0.93 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.208 1.939 . . . . 60.24 110.411 177.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.3 m -81.28 78.81 8.03 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.562 0.696 . . . . 74.43 110.696 -177.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.3 tt -86.18 107.45 17.89 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.066 -0.97 . . . . 73.52 109.109 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 m -71.23 104.31 3.07 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 110.056 -0.35 . . . . 74.24 110.056 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.4 m -75.49 85.19 2.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.06 0.457 . . . . 73.54 111.128 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.37 139.84 4.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.561 -0.745 . . . . 74.04 109.924 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.6 m -147.0 26.56 1.09 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.932 0.872 . . . . 74.42 109.072 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.91 -160.61 0.64 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.837 -1.074 . . . . 74.44 108.594 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -75.58 148.4 82.77 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 120.601 -0.44 . . . . 65.03 110.5 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.34 138.1 55.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.161 2.574 . . . . 65.54 112.614 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.52 144.77 96.68 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.827 -0.624 . . . . 62.13 110.483 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.74 123.26 13.42 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.982 2.455 . . . . 74.15 112.4 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.8 m -83.58 28.01 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-N 115.817 -0.629 . . . . 71.11 111.65 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -163.13 152.6 15.18 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.022 -0.535 . . . . 51.31 109.652 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.7 m 63.64 32.59 13.8 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.66 0.6 . . . . 75.41 110.416 -178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.8 141.1 92.13 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.37 -0.832 . . . . 63.32 110.476 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.42 174.71 10.46 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.471 2.114 . . . . 63.5 112.144 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m -83.91 -175.66 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 116.153 -0.476 . . . . 74.02 110.572 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.23 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.22 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 71.41 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.21 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.43 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.05 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.21 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.13 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.14 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 74.45 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.23 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.12 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.02 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.517 ' O ' HG22 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.54 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.13 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.466 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.1 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.44 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.44 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.433 ' CZ ' ' HB1' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.13 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.51 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 64.41 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.24 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.22 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.23 110.69 178.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 71.13 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.21 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.11 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.31 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.425 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.24 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.466 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 72.34 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.477 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.12 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.477 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.35 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.43 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.24 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.34 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.33 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.12 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.45 109.468 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.34 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 64.32 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.45 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.21 110.616 -176.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.22 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.54 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.4 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.52 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.43 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.22 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.34 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.01 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.31 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.43 109.885 -178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.15 110.322 178.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 63.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 65.44 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.34 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 73.32 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.31 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 73.04 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.45 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.44 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.02 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.479 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.35 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.05 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.41 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.558 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.42 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.69 ' O ' HG23 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.14 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.33 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.01 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.42 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 75.53 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.4 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 74.43 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.14 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 61.44 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.12 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.31 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.43 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.22 111.117 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.41 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.14 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.24 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.639 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.23 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 73.24 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.24 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.42 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -171.06 -42.39 0.02 OUTLIER 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.13 110.94 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.8 p -137.11 123.53 20.76 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.066 -0.516 . . . . 65.33 110.067 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -78.68 124.16 27.89 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 75.4 110.131 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -156.17 165.1 37.38 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.889 -0.596 . . . . 73.14 109.911 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.54 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.34 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.53 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.55 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 75.51 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 73.2 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 74.03 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.35 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.4 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.43 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p -169.67 171.74 7.28 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.54 110.299 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.6 m -159.49 136.6 9.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.16 -0.311 . . . . 72.12 110.16 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.766 -0.635 . . . . 73.31 110.38 179.5 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 74.9 t60 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.686 -0.487 . . . . 65.21 109.686 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 71.01 130.19 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.398 0.679 . . . . 32.11 111.716 -177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 32.04 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.43 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.42 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.13 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.15 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.12 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.3 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.41 153.9 75.43 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.2 112.208 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.0 118.61 1.77 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.88 -0.6 . . . . 35.4 110.289 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.41 175.89 13.41 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.086 -0.507 . . . . 75.23 110.735 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 p -85.01 147.94 49.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.251 -0.432 . . . . 71.54 111.553 -178.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.04 150.18 82.57 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.65 2.233 . . . . 74.34 111.35 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp -76.11 94.54 3.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.06 0.457 . . . . 72.14 111.248 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.45 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.21 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.24 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.41 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.11 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.03 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.21 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.51 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.15 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -85.77 129.15 38.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 65.31 111.364 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -160.47 -44.57 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.09 -0.959 . . . . 74.01 108.585 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.35 91.12 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 CA-C-N 115.173 -0.921 . . . . 64.54 109.243 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -76.41 -53.94 7.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.653 -0.703 . . . . 73.24 111.14 -176.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.0 m -83.25 133.79 47.01 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 115.989 -0.55 . . . . 72.12 110.499 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.75 120.82 8.76 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.626 2.218 . . . . 61.24 111.977 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.67 176.81 2.6 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 123.087 2.525 . . . . 74.44 112.181 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.47 154.1 84.97 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.961 -0.563 . . . . 64.23 110.256 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.99 -22.69 47.92 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 123.168 2.579 . . . . 74.41 113.309 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.77 -22.94 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.133 0.492 . . . . 62.13 110.524 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.3 m -91.48 143.0 27.05 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.607 -0.724 . . . . 72.05 109.324 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -88.12 134.63 33.72 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.281 -0.266 . . . . 72.14 110.281 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.96 -34.76 90.76 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.228 -0.51 . . . . 75.14 112.153 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.61 92.49 1.16 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.981 0.42 . . . . 55.32 110.857 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.82 95.19 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.888 -0.597 . . . . 53.11 110.068 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 60.8 mtt -144.9 92.14 5.86 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 109.313 -0.625 . . . . 71.41 109.313 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -85.36 103.64 0.8 Allowed 'Trans proline' 0 N--CA 1.448 -1.198 0 C-N-CA 122.683 2.255 . . . . 73.03 113.444 -177.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -85.06 99.53 11.09 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.03 -0.73 . . . . 64.1 109.03 175.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.15 121.32 3.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.934 -0.765 . . . . 60.4 108.934 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 m -158.24 13.92 0.2 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.788 0.328 . . . . 62.53 110.222 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.1 m 64.35 179.08 0.17 Allowed 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.738 -0.665 . . . . 72.11 111.719 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.08 -52.45 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.937 -0.574 . . . . 64.14 109.779 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.6 m 60.02 89.65 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.412 -0.813 . . . . 72.34 111.283 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.71 101.95 0.91 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-N 116.108 -0.497 . . . . 41.44 110.648 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.2 pm0 -81.17 144.8 54.96 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 115.51 -0.768 . . . . 74.41 110.36 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.84 116.48 4.31 Favored 'Trans proline' 0 C--O 1.239 0.529 0 C-N-CA 122.411 2.074 . . . . 75.33 111.782 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -77.64 127.74 81.6 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 63.12 111.191 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -80.06 116.21 3.36 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.71 2.273 . . . . 54.12 112.108 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.0 t -81.74 104.57 10.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.298 -0.41 . . . . 64.21 110.174 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.33 75.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 63.44 110.793 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.2 m -159.18 157.89 31.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.889 -0.596 . . . . 75.54 109.748 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 119.76 71.76 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 110.245 -0.28 . . . . 73.21 110.245 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -88.2 169.72 6.1 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.595 2.197 . . . . 74.41 112.519 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -89.63 151.69 3.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.251 -0.648 . . . . 74.45 109.251 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.11 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.33 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.02 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.44 111.732 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.53 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.14 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.23 111.262 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.34 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.21 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.3 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.5 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.2 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.21 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.55 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.508 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.32 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.31 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.586 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.13 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.42 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CZ ' ' HB1' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.44 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.32 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.586 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 74.43 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.34 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.4 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.32 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.44 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.01 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.65 ' HB1' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.43 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.23 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.41 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.52 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.32 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.514 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.02 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.2 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.35 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 95' ' ' PRO . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.51 107.949 173.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.57 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.24 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.33 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 73.04 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.31 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.488 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.56 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.3 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.53 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.11 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.31 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.21 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.15 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.44 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.12 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.447 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.22 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.647 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.3 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.13 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.647 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.488 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 54.03 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.44 109.703 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.21 112.471 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 75.5 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.12 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.32 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 74.35 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.43 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 62.15 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.32 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.15 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 64.25 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.33 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.54 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.24 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.564 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.03 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.461 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.33 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.2 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.03 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.54 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.04 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.51 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.12 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.11 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 73.55 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.24 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.04 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.02 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.05 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' A' ' 147' ' ' GLN . 0.1 OUTLIER -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.11 109.648 177.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.03 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 71.42 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.01 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.22 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -159.05 -37.48 0.06 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 63.03 110.163 178.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.6 m -135.63 -73.64 0.45 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.28 -0.418 . . . . 71.12 111.308 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.71 160.87 38.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.625 0.25 . . . . 63.32 110.658 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.67 102.76 11.71 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.355 -0.384 . . . . 62.33 110.495 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.03 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.45 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.43 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.24 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.55 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.32 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.21 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' SER . . . . . 0.417 ' C ' ' HG ' ' A' ' 168' ' ' SER . 20.8 t -168.59 175.62 6.09 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 74.51 109.083 -179.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' SER . . . . . 0.417 ' HG ' ' C ' ' A' ' 167' ' ' SER . 53.2 m -158.38 153.5 25.46 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.687 0.279 . . . . 71.53 110.254 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.438 -0.791 . . . . 64.35 109.747 177.92 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.4 m80 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.959 0.409 . . . . 74.44 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -117.17 -173.2 2.36 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.943 -0.571 . . . . 74.41 110.47 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.15 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 61.42 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.33 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.22 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.03 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.02 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.21 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.45 136.24 33.29 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.23 111.549 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 131.8 45.04 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.933 -0.576 . . . . 71.34 109.963 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.5 mt -141.95 133.24 26.41 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.163 -0.472 . . . . 73.32 109.941 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.9 p -82.66 122.15 78.32 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 116.071 -0.513 . . . . 54.42 110.39 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -57.3 128.69 30.59 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.489 2.126 . . . . 72.44 111.339 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.09 105.18 5.98 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.1 0.476 . . . . 75.23 110.087 -178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.4 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.42 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.24 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.53 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.12 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.14 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.33 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.52 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.51 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -99.87 121.9 51.11 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.02 112.043 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -86.09 109.4 18.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.808 -0.633 . . . . 70.05 110.078 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.5 p -83.17 114.19 23.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-O 121.239 0.542 . . . . 71.0 110.27 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -158.74 107.99 1.96 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.908 -0.587 . . . . 53.12 110.305 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.4 p -154.28 85.86 3.76 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 115.941 -0.572 . . . . 72.33 110.607 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -78.99 125.0 6.33 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.477 2.118 . . . . 72.03 112.092 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -54.63 132.4 51.21 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.878 2.385 . . . . 74.0 112.021 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.33 136.38 81.48 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.011 -0.54 . . . . 75.45 111.087 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -83.56 -155.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.702 2.268 . . . . 71.52 111.317 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -79.8 -41.61 21.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 120.94 -0.304 . . . . 45.32 110.941 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 21.8 m 50.82 81.89 0.06 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.457 0.703 . . . . 73.04 111.955 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -120.98 136.18 55.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.89 0.376 . . . . 75.13 111.002 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -162.99 110.36 0.42 Allowed Glycine 0 N--CA 1.437 -1.294 0 N-CA-C 111.435 -0.666 . . . . 44.11 111.435 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 42' ' ' MET . . . -165.77 -44.31 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 110.532 -0.173 . . . . 71.23 110.532 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 72.65 -35.46 0.33 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 61.02 111.993 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.441 ' H ' ' C ' ' A' ' 40' ' ' ALA . 24.8 ptt? -155.77 155.91 30.02 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.041 -0.726 . . . . 74.35 109.041 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.75 177.28 3.57 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 122.248 1.965 . . . . 74.33 111.618 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.9 p -81.09 145.07 31.27 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.668 -0.242 . . . . 75.51 110.824 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -159.9 178.13 10.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.567 -0.531 . . . . 71.25 109.567 -178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -76.68 -98.56 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.416 0.151 . . . . 64.03 110.891 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.4 m 59.83 172.92 0.08 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.682 0.623 . . . . 74.14 112.682 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 65.62 2.44 2.07 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.258 -0.883 . . . . 71.24 113.109 176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -91.04 -52.77 4.68 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.608 0.242 . . . . 74.43 111.199 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.69 -169.54 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.612 -0.722 . . . . 72.02 111.454 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -82.85 129.17 62.92 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 116.357 -0.383 . . . . 73.33 110.19 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.69 166.55 29.49 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.732 2.288 . . . . 71.44 111.985 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.3 mp -89.15 114.87 61.95 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 72.33 110.043 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -79.79 174.46 11.64 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.731 2.287 . . . . 65.12 112.625 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t 73.68 143.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 115.571 -0.741 . . . . 64.34 111.281 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.84 163.9 18.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.947 -0.57 . . . . 64.53 110.666 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t 65.85 81.11 0.21 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.439 0.638 . . . . 62.43 109.506 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.4 147.7 95.15 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 115.365 -0.834 . . . . 64.01 110.687 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -63.89 177.72 1.74 Allowed 'Trans proline' 0 C--O 1.236 0.414 0 C-N-CA 122.554 2.169 . . . . 55.13 111.625 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.98 176.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 116.329 -0.396 . . . . 54.24 110.844 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.41 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.45 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.14 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.02 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 63.33 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.12 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.419 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 71.33 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.42 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.13 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.419 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.11 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.41 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.32 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.44 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.607 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.23 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.33 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.31 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.607 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.31 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.33 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.449 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.22 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.33 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 75.01 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.51 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.32 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.35 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.42 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 88' ' ' SER . 3.9 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.13 111.475 -178.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.41 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 86' ' ' GLN . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.33 109.705 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.21 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.34 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.414 HD11 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 63.43 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.568 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.13 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' A' ' 91' ' ' LEU . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.23 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.679 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.33 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.679 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.13 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.13 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 72.1 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.1 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.568 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.55 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.3 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.21 108.883 177.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.23 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.448 HG23 ' H ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.14 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 72.22 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.22 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.11 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.52 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.24 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.52 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.3 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.13 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.12 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 26.7 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 74.13 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.53 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 74.24 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.13 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.44 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 75.44 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.2 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.2 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.32 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.523 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.13 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.4 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.01 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 74.54 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 74.11 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.52 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.22 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.42 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.459 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.34 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.34 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 70.44 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.32 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.13 110.049 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.13 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.14 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.44 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.31 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.52 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.53 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.24 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.13 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.23 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 71.2 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.34 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.22 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.41 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.53 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.42 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.522 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.41 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -135.73 -61.51 0.72 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.24 110.41 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.1 t -145.26 -170.95 3.56 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.64 -0.504 . . . . 64.5 109.64 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -77.41 126.9 31.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.788 0.328 . . . . 75.23 110.503 -178.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.77 171.43 20.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.885 -0.598 . . . . 74.53 110.227 -178.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.12 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.23 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.23 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.41 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 74.35 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.21 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.22 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.12 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.3 109.959 178.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t -73.78 95.22 2.36 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 13.3 m -79.07 162.27 25.98 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.723 -0.843 . . . . 75.11 108.723 176.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 118.168 -0.92 . . . . 72.15 109.587 178.443 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 34.5 m80 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.954 0.407 . . . . 72.43 111.003 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt -135.67 162.39 32.87 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.981 -0.748 . . . . 73.11 108.981 177.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 61.11 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.34 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.44 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.23 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.12 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.02 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.14 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.8 -172.91 1.46 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.14 111.846 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.3 162.28 25.08 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.152 -0.476 . . . . 73.21 110.49 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 96.6 mt -144.69 141.72 29.52 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.945 -0.761 . . . . 75.32 108.945 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -85.81 120.48 72.8 Favored Pre-proline 0 C--N 1.309 -1.174 0 CA-C-N 116.412 -0.358 . . . . 75.11 111.405 -178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -62.1 134.43 49.24 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.215 1.944 . . . . 63.31 109.822 175.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt -148.38 116.88 6.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.057 0.456 . . . . 74.34 110.989 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.43 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 75.11 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.54 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.55 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.45 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.24 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.32 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.14 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.44 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.21 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m -141.98 -175.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.44 110.401 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -145.99 145.92 30.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.827 0.346 . . . . 73.51 110.761 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.7 m -88.19 -169.98 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.952 -0.567 . . . . 71.1 110.149 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 23.8 t70 -152.71 137.65 17.18 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.734 0.302 . . . . 63.34 110.804 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.2 m -85.79 110.6 31.41 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 116.01 -0.541 . . . . 64.33 110.395 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' A' ' 30' ' ' ASP . 22.8 Cg_exo -65.39 127.37 18.04 Favored 'Trans proline' 0 C--O 1.238 0.49 0 C-N-CA 122.597 2.198 . . . . 62.23 111.788 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -65.03 134.13 38.5 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.657 2.238 . . . . 62.44 112.195 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.37 139.87 92.34 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.529 -0.545 . . . . 61.13 109.529 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.22 49.43 1.05 Allowed 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.884 2.39 . . . . 74.33 113.442 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.9 t -87.05 99.05 7.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.953 0.406 . . . . 75.31 110.041 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.0 p -91.51 -13.69 31.71 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.07 -0.514 . . . . 73.14 111.278 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -80.85 145.68 31.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.391 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 110.73 138.82 7.91 Favored Glycine 0 N--CA 1.438 -1.212 0 C-N-CA 120.741 -0.743 . . . . 64.42 111.717 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.15 100.35 0.85 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.034 0.445 . . . . 71.35 110.391 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -167.14 88.08 0.3 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.512 -0.767 . . . . 72.31 109.575 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -86.6 120.38 71.91 Favored Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 115.598 -0.728 . . . . 63.52 110.66 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.96 142.27 61.54 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.295 1.996 . . . . 74.45 110.95 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -151.25 157.24 42.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 116.691 -0.231 . . . . 72.33 110.662 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 tp 60.37 63.45 1.38 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.959 0.787 . . . . 74.41 111.505 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 p -170.39 135.66 1.26 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.781 -0.645 . . . . 74.24 110.196 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.5 m -135.52 -51.97 0.75 Allowed 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.375 -0.232 . . . . 74.51 110.375 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 61.51 -177.45 0.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.809 -0.632 . . . . 62.11 112.597 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.1 m -148.09 125.3 11.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.532 -0.758 . . . . 73.44 109.113 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.91 152.95 11.77 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.308 -0.256 . . . . 63.14 110.308 -178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -82.23 151.39 66.15 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.284 -0.416 . . . . 74.4 110.13 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HA ' ' OE1' ' A' ' 137' ' ' GLN . 60.9 Cg_exo -53.45 123.37 13.14 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.902 2.401 . . . . 72.12 111.963 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.36 124.17 89.91 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 116.09 -0.505 . . . . 41.51 111.072 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.84 111.73 2.48 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.286 1.991 . . . . 74.32 110.573 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 m -77.61 152.63 5.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.119 0.485 . . . . 75.34 111.753 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.4 -174.66 2.3 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.331 -0.85 . . . . 74.12 109.279 -178.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -71.96 122.17 20.38 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.403 -0.592 . . . . 64.15 109.403 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.92 114.82 22.62 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 55.42 112.393 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.81 -179.98 3.13 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.426 2.751 . . . . 62.21 110.919 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m -79.9 130.77 35.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.318 -0.623 . . . . 72.53 109.318 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 72.31 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.12 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.2 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.34 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.22 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.13 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 72.14 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.32 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.54 109.81 177.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.4 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.12 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.41 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.13 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.33 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.1 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.31 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.596 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 74.01 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.44 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.44 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.596 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.35 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 73.1 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.33 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.04 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.13 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.51 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.44 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.14 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 47.6 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.22 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.54 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.12 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.32 110.246 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.498 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 75.14 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.13 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.13 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.455 ' H ' ' C ' ' A' ' 95' ' ' PRO . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.12 108.542 174.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.03 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.54 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.13 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.05 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.33 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.23 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.476 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 73.12 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.3 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.24 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.43 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.53 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.14 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.425 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.53 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.22 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.529 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.3 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.42 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.42 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.22 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.43 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.1 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 71.53 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 71.51 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.31 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.04 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.24 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 54.12 110.371 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.12 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.23 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 63.42 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.22 110.267 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.505 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.33 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.41 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 75.34 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 75.01 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.35 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 72.03 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.42 111.308 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.41 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.451 ' OE1' ' HA ' ' A' ' 52' ' ' PRO . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.12 111.291 -179.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.41 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.34 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.32 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 70.24 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.24 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.441 HD13 ' H ' ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 73.24 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.43 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.11 111.149 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.54 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.11 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.01 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 53.11 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.41 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.414 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.41 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' SER . . . . . 0.786 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.3 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 72.73 -48.06 0.68 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.51 110.091 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.0 p -162.03 -173.08 3.5 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 107.958 -1.127 . . . . 74.32 107.958 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -110.29 101.4 10.15 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.937 -0.705 . . . . 75.21 110.922 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -168.3 91.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.258 -0.883 . . . . 63.41 109.942 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.11 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.43 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.21 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 75.21 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.11 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.31 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.3 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.12 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.41 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.35 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m -163.52 91.36 0.67 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.23 110.295 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 10.4 p -81.76 84.86 6.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.027 0.442 . . . . 54.33 110.604 178.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.394 -0.812 . . . . 75.43 110.458 -179.882 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.1 mtm . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 120.69 0.281 . . . . 71.54 111.08 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.24 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.23 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 70.23 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.51 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.15 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.55 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.32 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.42 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo . . . . . 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.34 112.088 -179.531 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.846 0.355 . . . . 63.0 110.495 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.2 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.41 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.03 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 31.5 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.52 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.54 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.24 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.22 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.24 111.207 -179.866 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 120.717 0.294 . . . . 73.24 110.962 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.607 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.53 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 64.34 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.53 108.823 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.4 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 52.31 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.11 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.32 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.04 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 42.54 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.607 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.01 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.32 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.03 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.12 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.425 ' HA ' HD13 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.42 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.01 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.55 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.22 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.03 111.273 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.34 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 64.1 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.699 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.44 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.15 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.41 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.54 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.688 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.31 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.42 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.55 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.11 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.34 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.461 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.21 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.53 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 73.24 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.44 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.15 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.22 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 61.22 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.461 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.14 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.51 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 65.42 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.42 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.31 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.41 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 72.11 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.01 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.13 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.4 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.3 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.31 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.44 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.34 112.199 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.31 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.42 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.21 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.11 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 61.15 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.688 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.1 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.35 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 45.21 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 55.23 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.11 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.13 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.54 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.2 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.14 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.522 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.15 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.55 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.22 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.33 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.53 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.43 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.418 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.21 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.33 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.01 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.35 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.55 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.34 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.41 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.22 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.41 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.52 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.23 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.01 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.44 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.14 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.44 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.688 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.12 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.54 109.198 178.513 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.748 -0.464 . . . . 55.14 109.748 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.54 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.11 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.23 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.21 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 33.12 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.22 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.32 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.21 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' GLN . . . . . 0.581 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.31 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.14 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.23 110.635 -177.246 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.705 -0.479 . . . . 64.21 109.705 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.45 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.24 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.443 ' O ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.41 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.14 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 74.32 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.4 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo . . . . . 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.21 111.829 179.294 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 16' ' ' LEU . 2.2 pp . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.818 0.342 . . . . 72.42 110.936 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.53 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.42 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.04 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.14 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.14 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.15 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.41 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.32 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 55.3 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.03 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p . . . . . 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.43 109.938 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.235 0.337 0 CA-C-O 121.076 0.465 . . . . 75.11 111.166 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 93' ' ' LEU . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.45 110.527 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.34 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.32 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.43 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.57 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.02 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.15 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.42 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.3 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.44 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.1 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 62.22 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.31 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.15 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.34 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 64.53 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.32 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.13 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.487 HG11 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.31 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.467 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.45 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.43 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.531 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.14 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.34 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.42 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.03 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.51 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.41 HE21 ' HD1' ' A' ' 81' ' ' PHE . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.24 110.336 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.547 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.53 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.02 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 72.33 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.23 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 103' ' ' ILE . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.22 109.464 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.13 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.05 112.437 -172.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.553 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 74.22 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 70.24 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.52 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.15 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.42 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.34 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.43 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 91' ' ' LEU . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.21 108.575 177.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.43 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.422 HD11 HD22 ' A' ' 91' ' ' LEU . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.53 110.633 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.565 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.52 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.34 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.42 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.3 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.54 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.44 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.11 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.21 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.519 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.43 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.44 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.12 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.565 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 64.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.42 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 72.4 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.34 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.22 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.12 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.13 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.12 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.13 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.31 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.34 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.43 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.43 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.1 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.23 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.41 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.24 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.457 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.44 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.51 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.23 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.12 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.44 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.41 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.35 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.21 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.3 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.54 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.23 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.1 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.35 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.51 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.02 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.35 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.45 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.53 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.03 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.23 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 61.43 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.34 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.34 111.463 179.287 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 120.863 0.363 . . . . 73.5 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.54 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.14 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.01 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.15 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.31 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.04 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.01 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.44 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.43 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.44 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.15 110.093 -179.077 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 121.106 0.479 . . . . 55.23 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 60.33 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.42 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.21 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.1 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.67 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.53 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.67 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.22 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.21 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.41 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.45 113.118 -177.056 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.582 0.23 . . . . 53.24 110.526 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.51 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.3 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.04 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.02 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.33 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.22 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 53.42 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.04 110.74 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.53 110.728 178.593 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.15 109.811 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.438 HD23 HD11 ' A' ' 93' ' ' LEU . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.43 110.705 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 62.44 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.31 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.3 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 65' ' ' LEU . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 52.04 110.288 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.31 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.45 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.14 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.21 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.45 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.41 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 70.24 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.594 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.01 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.54 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.01 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.44 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 64.41 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.03 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 64.42 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.54 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.53 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.43 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.406 ' OE1' ' HG ' ' A' ' 80' ' ' LEU . 47.8 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.12 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.13 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.24 111.197 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.44 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.11 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 51.55 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.43 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.44 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.52 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.438 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.683 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.04 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.683 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.01 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.42 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.12 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.55 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.54 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.41 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.45 107.809 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.533 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.53 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.3 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.743 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 52.03 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.53 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.32 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.35 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.11 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.22 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.531 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 54.3 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.21 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 63.14 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.03 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 65.02 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.12 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.533 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 61.41 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.21 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.44 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 63.13 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 52.3 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.24 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 51.52 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.24 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.15 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.11 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.13 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.33 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.01 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.11 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.432 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.53 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.41 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 43.02 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.24 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 70.54 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.44 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.24 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.45 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.53 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.4 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.23 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.12 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.23 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.504 HD23 ' HB3' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.52 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.15 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 61.32 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.42 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.15 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 60.12 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.14 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.11 110.777 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 120.852 0.358 . . . . 63.24 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.45 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.23 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 62.34 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' GLN . . . . . 0.453 ' OE1' ' HA ' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.22 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.01 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.34 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.23 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.51 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.42 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.21 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.41 109.148 179.43 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.444 -0.746 0 N-CA-C 108.863 -0.791 . . . . 74.14 108.863 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.42 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.52 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.45 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.41 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.44 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.3 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.32 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.33 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.23 111.665 179.811 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 N--CA 1.447 -0.608 0 CA-C-O 120.752 0.31 . . . . 53.31 110.503 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.14 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.13 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.31 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.42 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.03 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.22 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.21 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.43 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.1 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.45 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.14 110.37 178.181 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.747 0.308 . . . . 65.14 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 72.41 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.31 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 52.35 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.14 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.2 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.22 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 41.35 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.31 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.13 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.21 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.41 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.436 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.03 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 40.42 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 50.4 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.35 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.15 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.04 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.15 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 61.22 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 54.2 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.04 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.54 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.45 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.43 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.22 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.44 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.44 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.53 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 52.23 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.43 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.55 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 101' ' ' VAL . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.22 111.461 -177.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.586 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.13 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.586 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.24 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.23 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.42 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.4 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.32 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.42 109.274 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.24 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.1 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 62.13 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 62.41 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.44 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.32 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.34 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.11 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.21 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.445 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.01 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.34 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.509 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 63.45 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.04 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.532 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.1 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.436 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.44 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.32 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.45 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.04 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.53 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.24 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.21 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.21 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.22 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.44 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.31 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.31 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.44 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.34 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 52.45 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.505 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.35 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.4 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.44 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.53 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.4 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.464 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.43 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 63.32 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.34 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.33 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.41 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.44 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.31 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.21 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.52 110.837 -178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 42.31 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 73.43 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.32 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.14 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 51.42 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.986 0.422 . . . . 64.41 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.14 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.52 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 52.02 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.11 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 42.25 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.14 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 41.34 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.11 109.437 176.469 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.235 0.327 0 N-CA-C 109.594 -0.521 . . . . 72.33 109.594 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.42 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.34 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.42 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.54 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 52.01 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.23 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo . . . . . 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.33 112.074 179.532 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.391 0 CA-C-O 120.914 0.388 . . . . 63.35 110.943 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 64.33 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.34 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.52 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.2 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.52 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.13 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.55 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.51 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.22 109.318 175.7 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.087 -0.708 . . . . 62.45 109.087 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 72.41 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.34 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 61.21 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.35 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 123' ' ' VAL . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.54 110.633 -175.155 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.42 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 43.5 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.31 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.11 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.548 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 73.01 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.03 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.33 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.22 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.496 ' O ' HG23 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.12 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 34.32 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.1 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.35 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.2 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.41 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 52.24 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.01 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.41 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.03 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.24 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.54 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.03 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.34 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.593 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.42 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.32 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.8 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.51 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 61.21 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.24 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.541 HD12 HG21 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.03 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.504 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 70.13 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.504 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.41 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.45 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.31 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.409 HD22 ' HG2' ' A' ' 119' ' ' PRO . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.31 111.345 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.33 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.33 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.541 HG21 HD12 ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 73.54 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.549 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.11 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.623 HD11 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.03 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.42 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.01 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.54 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.45 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.05 108.419 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.623 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 54.15 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.13 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 145' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 72.02 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.43 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.32 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.34 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.468 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.14 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.2 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.14 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.01 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.469 HG13 HD21 ' A' ' 65' ' ' LEU . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.3 109.176 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.32 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.32 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.41 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.41 109.693 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.41 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.34 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.24 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 65.41 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.24 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.33 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.41 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.12 110.542 178.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.14 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.45 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.4 HD12 HD22 ' A' ' 145' ' ' LEU . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.3 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 54.13 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.12 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.05 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.45 110.186 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 114' ' ' LEU . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.02 109.803 177.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.44 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.44 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.21 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.22 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.4 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.02 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.1 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 . . . . . 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 61.4 111.121 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.057 0.456 . . . . 52.2 110.355 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.12 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.53 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.05 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.44 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.23 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.22 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 30.55 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.43 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.22 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 64.41 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.12 110.451 -177.403 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 121.028 0.442 . . . . 72.34 112.191 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.11 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 43.31 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.24 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 51.4 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.2 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 54.22 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.41 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.43 111.672 -179.205 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.237 0.437 0 CA-C-O 120.727 0.299 . . . . 74.42 110.613 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 64.13 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.33 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.23 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.13 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.21 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.02 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.14 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 61.35 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 53.52 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.13 110.884 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.22 108.55 176.193 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.506 -0.553 . . . . 44.12 109.506 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.42 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.04 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.14 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.04 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.44 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 54.24 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.32 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 72.32 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.55 111.143 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.12 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 71.11 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 78' ' ' VAL . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 64.21 109.135 176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.13 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.14 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.52 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 74' ' ' PHE . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 64.34 110.879 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.477 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 55.23 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.52 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 86' ' ' GLN . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.14 111.484 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.45 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.41 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.2 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.44 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' PHE . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.04 109.713 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.3 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 63.13 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.15 112.842 -177.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.42 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.44 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.2 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.45 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.513 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.33 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.513 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 64.02 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.448 HD12 ' HG3' ' A' ' 97' ' ' GLU . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.03 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.21 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.41 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.41 110.222 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 71.54 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 64.1 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.439 HD11 ' HB1' ' A' ' 112' ' ' ALA . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.13 110.91 -177.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.44 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.464 HD11 HD13 ' A' ' 143' ' ' ILE . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.44 111.063 -172.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.53 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.12 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.41 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.21 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.51 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.554 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.3 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.43 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 65.41 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 65.54 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.02 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.23 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.425 ' OG ' HG22 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.41 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.24 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.425 HG22 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.23 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.526 ' HD3' HG21 ' A' ' 150' ' ' ILE . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.41 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.12 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 55.51 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.21 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.34 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.622 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.33 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.4 112.587 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.11 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.622 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 63.43 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.42 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.54 111.745 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 71.13 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.02 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.22 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.42 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.44 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.41 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.464 HD13 HD11 ' A' ' 107' ' ' LEU . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.15 110.768 -179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.14 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 64.15 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.41 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.43 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.23 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.436 ' HB2' ' HA ' ' A' ' 115' ' ' GLN . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.34 109.529 176.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.526 HG21 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.43 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.11 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.82 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.51 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.21 106.384 179.37 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 109.573 -0.528 . . . . 74.23 109.573 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.33 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 62.42 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.52 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.42 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.13 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.42 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 64.44 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.04 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.12 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 40.34 109.983 -179.327 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 62.24 110.662 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.21 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 64.1 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.12 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.32 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.413 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.42 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.41 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 61.32 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.12 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.51 111.954 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.872 0.367 . . . . 63.33 111.091 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.1 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 74.52 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.15 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.55 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.32 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.11 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.53 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.13 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.44 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.42 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.12 109.891 177.199 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.425 HD23 HD11 ' A' ' 93' ' ' LEU . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.14 111.182 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.31 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.15 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.53 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.4 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.05 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.13 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.42 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.53 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.11 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.12 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 71.12 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.22 111.03 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.03 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.41 ' NE2' HD12 ' A' ' 91' ' ' LEU . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.41 112.491 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.405 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.13 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.515 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.21 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.12 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.32 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 70.12 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.55 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.42 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 63.42 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.24 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.34 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.24 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.41 HD12 ' NE2' ' A' ' 77' ' ' GLN . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.1 110.125 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.15 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.32 112.488 -175.378 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.647 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 89.3 m-70 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.647 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.41 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.34 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.12 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.13 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.55 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.34 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.33 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.53 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.13 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.01 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.598 HD11 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.14 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.54 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.23 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.32 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.04 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.44 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.02 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.598 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.1 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.43 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.02 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.41 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.468 ' SD ' HD11 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.42 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.33 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.12 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.15 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.0 m80 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.15 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.51 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 72.41 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.33 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 45.24 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 32.01 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.13 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.468 HD11 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.02 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.15 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.563 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.2 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 62.14 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.02 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.563 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.2 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.559 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.23 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.11 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.35 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.13 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.44 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.35 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.04 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.22 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.31 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.22 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.14 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.33 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.03 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 64.05 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 63.01 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.1 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.12 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.12 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.03 109.607 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 120.94 0.4 . . . . 51.4 110.706 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.51 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.03 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.21 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' GLN . . . . . 0.434 ' CD ' ' H ' ' A' ' 160' ' ' GLN . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.31 111.323 -178.199 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.15 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 43.32 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.33 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.52 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.2 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.24 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.52 110.476 -178.173 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 C--O 1.238 0.491 0 N-CA-C 109.975 -0.38 . . . . 74.31 109.975 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.05 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.34 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.23 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.21 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.32 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.52 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 70.32 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.15 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.12 111.505 179.57 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 121.015 0.436 . . . . 64.01 110.705 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 71.21 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.34 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.01 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.42 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.22 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.11 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.43 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.41 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.42 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.12 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p . . . . . 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.31 110.754 178.694 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.448 -0.574 0 CA-C-O 121.001 0.429 . . . . 73.41 110.317 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.549 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 53.34 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.24 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.51 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 64.12 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.54 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.23 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.2 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.42 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.43 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.549 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.05 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 53.14 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.2 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.24 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.23 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 55.54 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.24 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.673 HE22 HD13 ' A' ' 91' ' ' LEU . 49.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.52 111.161 179.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.14 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.34 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.42 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.3 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 42.24 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 72.52 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.11 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.23 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.41 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 61.41 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.34 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.511 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.33 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.673 HD13 HE22 ' A' ' 77' ' ' GLN . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.52 111.901 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 62.33 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.14 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.453 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.04 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.453 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.41 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.01 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.12 110.372 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.33 110.933 176.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.52 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.13 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 53.42 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 73.51 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.24 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.03 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 74.52 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.34 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.14 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.24 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.52 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.51 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.522 ' HB3' HD23 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.41 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.12 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.05 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.12 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.403 ' HG3' HG13 ' A' ' 103' ' ' ILE . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.1 108.695 -176.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 60.14 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 44.44 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.52 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 61.43 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.41 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.51 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.03 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.41 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.54 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.35 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.12 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.05 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.12 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.52 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.35 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 61.51 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 71.43 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.44 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLN . . . . . 0.418 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 84.5 mm-40 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.33 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.23 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.23 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.42 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.33 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.52 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.12 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.522 HD23 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.23 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.01 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 50.6 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.44 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.03 110.384 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.02 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.34 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.13 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.22 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.955 179.445 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.816 0.341 . . . . 75.32 110.771 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.11 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.1 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.12 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.41 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 54.3 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.41 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.41 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.42 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.41 111.52 -178.722 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 110.193 -0.299 . . . . 73.23 110.193 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.45 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 63.1 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.33 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.44 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.22 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.31 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 65.34 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 11' ' ' PRO . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.4 112.537 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 10' ' ' GLY . 94.8 Cg_endo . . . . . 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.45 112.098 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-O 120.9 0.381 . . . . 71.52 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.15 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.12 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.44 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.1 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.21 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.51 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.11 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.54 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.51 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.53 110.434 -179.238 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.002 -0.74 . . . . 43.04 109.002 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 43.12 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.13 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HB1' ' HD2' ' A' ' 64' ' ' PRO . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.413 ' HD2' ' HB1' ' A' ' 63' ' ' ALA . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.53 110.76 176.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.43 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.23 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.41 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.33 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.04 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.01 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.44 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.1 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.684 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.2 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.14 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.4 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.12 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.13 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.13 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.43 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.44 111.757 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.23 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 72.44 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.41 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.21 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 74.31 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 41.55 111.214 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.42 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.13 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.51 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.02 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.4 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.23 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.04 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.34 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 45.2 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.24 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.55 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.2 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.501 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 54.1 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.43 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.53 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.671 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.14 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.11 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.42 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.23 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.12 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.58 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.13 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.671 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.53 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.1 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.426 ' CD2' HD22 ' A' ' 145' ' ' LEU . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.13 111.519 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.11 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.43 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.572 HG13 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.44 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.22 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.14 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.23 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.44 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.33 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.52 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.35 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 52.53 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.45 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.42 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.44 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.41 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.426 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.24 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.51 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.42 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.41 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 55.31 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.14 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.03 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.34 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 43.15 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.52 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.03 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.15 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.41 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.58 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 62.45 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 114' ' ' LEU . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.32 110.044 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.41 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.464 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.52 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.23 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.47 ' HG ' ' N ' ' A' ' 156' ' ' ALA . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 55.24 112.265 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.15 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.572 ' H ' HG13 ' A' ' 117' ' ' VAL . 37.2 mt-10 . . . . . 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.24 111.647 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.47 ' N ' ' HG ' ' A' ' 151' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.813 0.34 . . . . 63.35 110.768 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.05 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.43 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.24 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.35 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.13 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 44.22 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.35 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.41 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 13.8 tm0? -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.13 109.654 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 51.31 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.82 0.343 . . . . 55.1 111.195 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 71.3 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.04 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 55.22 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.13 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.501 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.1 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.501 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.33 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.3 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.34 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo . . . . . 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.12 111.031 178.267 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.838 0.351 . . . . 64.22 110.312 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 65.24 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.53 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.04 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.4 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.23 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.22 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.41 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.43 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.41 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p . . . . . 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 63.43 108.187 176.384 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 120.673 0.273 . . . . 75.11 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 72.13 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 52.31 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 63.33 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.24 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.34 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.01 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 62.31 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.41 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.456 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.12 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.13 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.11 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 73.15 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.14 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.22 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.11 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.14 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.43 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.51 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.51 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.23 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.44 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.21 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 53.8 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.01 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.32 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.57 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 43.21 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.15 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.416 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.05 109.038 175.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.22 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.52 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 64.14 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.2 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.23 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.33 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.42 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.53 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.21 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.43 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 72.31 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.13 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.22 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.3 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.15 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.24 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.12 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.558 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.12 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.41 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.558 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.42 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.15 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.4 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.41 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.53 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.559 HG13 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 74.54 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.34 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 70.35 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.23 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.43 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.45 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 63.54 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.41 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.13 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.32 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.52 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.51 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 42.52 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.568 ' O ' HG22 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.04 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 64.31 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.21 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.24 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 133' ' ' MET . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.11 110.06 178.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.401 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.44 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 70.22 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.23 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.401 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.32 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.24 110.124 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.34 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.15 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.33 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.03 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.21 109.185 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.33 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.559 ' H ' HG13 ' A' ' 117' ' ' VAL . 42.3 mt-10 . . . . . 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.23 109.519 -176.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 110.051 -0.352 . . . . 73.23 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.13 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.41 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.33 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 71.23 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.14 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 64.54 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.23 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.14 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.04 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.01 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 63.15 110.821 -179.232 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 110.118 -0.327 . . . . 65.1 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.13 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.44 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.613 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.31 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.12 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.613 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.1 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.41 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.04 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 34.45 111.852 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 120.758 0.313 . . . . 72.34 110.448 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.01 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.31 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.41 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.33 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.53 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.21 110.799 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.12 109.231 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.44 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.23 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 64.33 111.044 -179.771 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.991 -0.374 . . . . 64.1 109.991 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.34 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.44 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.22 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.21 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.64 ' H ' HD23 ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 65.42 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 55.32 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.12 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.42 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.33 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.53 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.35 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.668 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.04 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.53 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.11 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.1 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.12 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.54 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.541 HD13 ' HD3' ' A' ' 83' ' ' ARG . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.42 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.14 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.05 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' HD13 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.32 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.15 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.31 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 61.35 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.1 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.4 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.4 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.22 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.42 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.04 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.24 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.42 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.01 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.14 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.14 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.03 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.11 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 43.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.555 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 73.24 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.54 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 65.04 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 60.03 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.34 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.35 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.52 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 65.22 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.44 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.13 109.354 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.4 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.489 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.23 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 72.1 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.53 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.22 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.1 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.52 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.43 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.44 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.04 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.41 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.03 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 127' ' ' LEU . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.22 110.347 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.02 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 61.3 111.972 177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.03 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.1 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.23 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 63.21 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.11 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.4 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.21 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.04 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.11 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.04 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.52 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 61.42 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.24 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.34 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.21 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.41 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.12 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.52 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.43 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.43 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.14 108.293 176.068 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 110.206 -0.294 . . . . 73.53 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.54 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 33.31 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.32 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.01 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.23 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.4 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.53 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 61.3 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.44 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.35 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 63.04 110.5 -179.156 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 C--O 1.239 0.515 0 N-CA-C 109.921 -0.4 . . . . 74.43 109.921 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.31 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.33 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.24 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.23 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.34 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.34 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.34 112.694 -178.638 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.932 0.396 . . . . 63.11 110.996 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 54.12 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.45 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 72.42 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.52 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.31 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.33 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.13 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 61.43 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 53.44 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.33 109.877 178.671 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.697 0.284 . . . . 74.02 110.572 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.23 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.22 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 62.51 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.21 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.43 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.05 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.21 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.13 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.14 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 73.0 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.23 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.12 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.02 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 71.41 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.54 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.13 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.552 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.1 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.44 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.44 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.13 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.51 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 52.11 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.24 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.22 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.23 110.69 178.089 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 52.11 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.21 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.11 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.31 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.435 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.24 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.552 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 53.2 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.12 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.35 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.43 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.24 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.34 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.33 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.12 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.419 ' HB ' HD12 ' A' ' 93' ' ' LEU . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.45 109.468 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.34 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 63.21 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.44 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.21 110.616 -176.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.22 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.54 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.4 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.52 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.43 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.22 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.34 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.01 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.31 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.477 ' HE1' ' HB3' ' A' ' 114' ' ' LEU . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.43 109.885 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.435 HG13 ' HA ' ' A' ' 153' ' ' GLU . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.15 110.322 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 61.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 53.33 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.34 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 63.31 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.31 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 64.53 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.45 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.44 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.02 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.487 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.35 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.05 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.528 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.41 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.42 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.7 ' O ' HG22 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.14 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.33 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.01 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.7 HG22 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.42 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 74.02 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.4 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 64.52 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.14 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 54.41 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.12 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.31 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.43 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.474 HD22 HD23 ' A' ' 114' ' ' LEU . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.22 111.117 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.41 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.14 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.24 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.23 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 72.34 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.24 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.42 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HA ' HG13 ' A' ' 117' ' ' VAL . 15.1 pt-20 . . . . . 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.13 110.94 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.577 0 N-CA-C 109.911 -0.403 . . . . 73.14 109.911 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.54 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.34 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.53 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.55 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 52.21 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 71.42 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 64.34 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.35 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.4 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.43 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.54 110.299 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 121.128 0.49 . . . . 32.11 111.716 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 13.22 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.34 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.42 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.13 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.15 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.12 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.3 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.2 112.208 -178.567 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 121.06 0.457 . . . . 72.14 111.248 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.45 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.21 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.24 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.41 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.11 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.03 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.21 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.51 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.15 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 52.44 111.364 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.251 -0.648 . . . . 74.45 109.251 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.11 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.33 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.02 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.423 ' HB2' ' HB2' ' A' ' 67' ' ' SER . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.44 111.732 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.53 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.14 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' PRO . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.23 111.262 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.34 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.21 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.3 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.14 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.2 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.21 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.55 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.579 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.32 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.31 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.13 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.42 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.44 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.32 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 65.24 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.34 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.4 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.32 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.44 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.01 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.43 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.23 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.41 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.529 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.52 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.32 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.526 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.02 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.2 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.35 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.51 107.949 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.644 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.24 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.33 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 71.22 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.31 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.569 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.3 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.53 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.02 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.31 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.21 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.23 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.15 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.44 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.12 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.22 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.651 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.3 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.13 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 52.45 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.4 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.44 109.703 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 118' ' ' SER . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.21 112.471 177.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 73.33 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.12 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.32 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 62.4 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.43 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 44.32 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.32 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.15 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 41.54 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.33 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.54 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.24 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.578 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.03 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.33 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.2 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.03 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.54 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.04 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.51 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.12 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.11 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 64.0 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.24 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.447 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.04 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.02 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.05 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.11 109.648 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.03 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 61.22 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.01 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.22 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 61.02 110.163 178.066 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 120.884 0.373 . . . . 62.33 110.495 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.03 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.45 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.43 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.24 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.55 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.32 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.21 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' GLN . . . . . 0.46 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 63.52 109.083 -179.038 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 120.905 0.383 . . . . 74.41 110.47 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.15 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 60.43 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.33 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.22 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.03 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.02 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.21 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.23 111.549 179.097 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.446 -0.67 0 CA-C-O 121.1 0.476 . . . . 62.53 110.087 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.4 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.42 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.24 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.53 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.12 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.14 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.33 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.52 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.51 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.02 112.043 -179.345 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.916 0.389 . . . . 54.24 110.844 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.41 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.45 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.14 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.02 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 62.24 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.12 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 62.3 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.55 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.42 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.13 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.11 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.41 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.32 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.44 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.63 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.23 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.33 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.31 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.31 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.33 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.22 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.33 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 74.33 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.51 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.32 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.35 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.42 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.13 111.475 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.41 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.33 109.705 -177.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.21 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.34 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.453 HD13 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 62.22 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.13 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 101' ' ' VAL . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.23 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.672 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.33 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.672 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.13 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.13 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 44.13 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.1 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.592 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.55 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.3 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 93' ' ' LEU . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.21 108.883 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.23 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.409 HG22 ' N ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.14 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 64.24 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.22 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.11 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.52 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.24 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.52 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.3 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.13 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.12 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 76.6 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 54.21 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.53 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 61.23 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.13 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.44 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 73.3 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.2 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.2 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.32 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.524 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.13 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.4 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.01 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 73.1 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 64.25 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.53 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.22 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.42 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.48 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.34 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.34 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 63.44 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.32 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.13 110.049 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.13 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.14 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.44 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.31 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.52 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.53 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.24 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.13 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.23 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 54.24 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.34 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.22 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.41 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.53 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.42 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.41 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.24 110.41 178.423 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.227 -0.286 . . . . 74.53 110.227 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.12 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.23 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.23 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.41 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 45.14 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.21 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.22 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.12 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 166' ' ' GLN . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.3 109.959 178.11 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 CA--C 1.509 -0.611 0 N-CA-C 108.981 -0.748 . . . . 73.11 108.981 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 51.35 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.34 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.44 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.23 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.12 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.02 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.14 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.14 111.846 179.638 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.057 0.456 . . . . 71.1 110.989 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.43 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 42.04 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.54 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.55 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.45 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.24 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.32 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.14 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.44 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.21 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.44 110.401 -178.793 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.318 -0.623 . . . . 72.53 109.318 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 71.45 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.12 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.2 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.34 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.22 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.13 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 64.44 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.32 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.417 ' HE1' HD22 ' A' ' 93' ' ' LEU . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.54 109.81 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.25 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.12 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.23 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.13 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.33 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.1 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.31 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.606 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 73.34 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.44 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.44 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.35 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 60.1 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.33 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.04 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.13 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.51 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.44 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.14 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 49.4 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.22 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.54 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.12 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.417 HD22 ' HE1' ' A' ' 70' ' ' TRP . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.32 110.246 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 61.12 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.13 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.13 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.12 108.542 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.03 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.54 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.13 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.05 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.33 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.23 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.516 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 60.15 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.566 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.3 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.24 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.43 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.53 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.14 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.53 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.22 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.566 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.3 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.42 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.42 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.22 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.43 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.1 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 33.32 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 61.31 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.31 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.04 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.24 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 51.32 110.371 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.12 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.23 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 54.13 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.22 110.267 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.33 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.41 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 65.13 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 51.11 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.35 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 70.0 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.432 ' HB3' HD12 ' A' ' 145' ' ' LEU . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.23 111.308 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.41 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.12 111.291 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.41 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.34 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.32 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 62.02 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.24 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 61.22 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.436 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.43 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.432 HD12 ' HB3' ' A' ' 135' ' ' ARG . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.11 111.149 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.54 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.11 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.01 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 51.22 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.41 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.41 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' SER . . . . . 0.793 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.3 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.51 110.091 -176.845 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.942 -0.392 . . . . 63.41 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.11 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.43 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.21 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 64.53 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.11 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.31 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.3 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.12 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.41 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.35 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.23 110.295 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.851 -0.426 . . . . 70.14 109.851 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.1 mtm 73.8 171.08 0.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.502 0.721 . . . . 71.54 111.08 -177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.24 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.23 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 70.23 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.51 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.15 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.55 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.32 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.42 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.29 154.34 68.61 Favored 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.34 112.088 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.3 84.52 0.3 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.095 -0.502 . . . . 61.24 110.857 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.8 mt -152.19 149.75 29.09 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.184 -0.673 . . . . 61.44 109.184 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 60.7 m -88.11 117.49 68.48 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-O 120.587 0.232 . . . . 74.13 111.258 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 14' ' ' THR . 6.0 Cg_exo -79.8 137.76 12.84 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.528 2.152 . . . . 34.25 110.938 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp -161.67 115.52 1.91 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.846 0.355 . . . . 63.0 110.495 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.2 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.41 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.03 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 31.5 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.52 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.54 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.24 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.22 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t 72.95 147.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.24 111.207 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 67.96 89.91 0.1 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.832 -0.622 . . . . 72.15 110.422 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.8 p -171.25 146.19 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 115.378 -0.828 . . . . 44.55 109.511 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.4 t70 70.03 167.07 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.022 0.529 . . . . 73.15 110.74 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -150.78 145.23 18.05 Favored Pre-proline 0 C--N 1.32 -0.703 0 O-C-N 122.228 -0.295 . . . . 65.32 110.752 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.48 143.28 68.66 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.039 2.493 . . . . 71.13 112.9 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.91 130.56 9.59 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 122.99 2.46 . . . . 54.01 112.393 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -74.65 120.72 82.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.992 -0.549 . . . . 40.53 111.401 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 18.6 Cg_exo -66.66 143.05 66.55 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.623 2.215 . . . . 74.23 111.835 178.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.9 m -145.12 145.46 20.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.197 -0.456 . . . . 63.2 110.231 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.1 m -151.37 139.04 19.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.493 -0.321 . . . . 73.12 110.273 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -117.0 166.32 12.33 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.209 -0.293 . . . . 71.43 110.209 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.53 -99.67 0.12 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 74.44 112.346 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 63.96 -172.51 0.17 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.095 0.558 . . . . 73.43 111.508 -179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.92 -30.32 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.375 -0.375 . . . . 71.42 110.946 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.9 mtp 65.91 99.11 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.496 0 C-N-CA 123.239 0.615 . . . . 74.55 111.672 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.68 112.57 1.51 Allowed 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 122.499 2.132 . . . . 64.42 111.587 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -83.94 154.48 23.35 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.038 -0.528 . . . . 75.12 109.882 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -147.85 118.33 7.44 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.665 -0.495 . . . . 53.23 109.665 -177.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.6 m -68.25 135.88 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.175 -0.466 . . . . 75.42 110.912 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 p -68.73 111.65 4.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.91 -0.586 . . . . 44.22 110.933 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.15 138.98 52.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.324 -0.398 . . . . 72.24 110.571 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.2 m -86.33 138.18 32.02 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.963 -0.562 . . . . 65.11 110.083 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.11 168.12 19.43 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.512 -0.551 . . . . 73.11 109.512 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -78.66 141.68 60.52 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.738 -0.467 . . . . 64.34 109.738 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 141.23 92.96 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.088 2.525 . . . . 70.52 111.978 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.448 HD12 ' O ' ' A' ' 53' ' ' LEU . 1.1 pp -77.49 135.23 65.22 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 116.304 -0.407 . . . . 62.4 111.356 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 33.5 Cg_exo -59.65 138.26 82.26 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.794 2.329 . . . . 73.23 111.582 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.0 m -147.43 -173.14 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.222 -0.445 . . . . 73.15 110.781 -177.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.04 -176.4 4.49 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.154 -0.684 . . . . 55.14 109.154 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -73.51 121.42 20.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.808 -0.442 . . . . 73.24 109.808 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 135.92 89.67 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.193 -0.458 . . . . 63.33 111.422 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.528 ' O ' HG22 ' A' ' 60' ' ' VAL . 43.9 Cg_endo -70.96 119.53 6.38 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.409 2.073 . . . . 74.05 110.267 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.528 HG22 ' O ' ' A' ' 59' ' ' PRO . 4.0 m 55.33 -176.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.068 0.947 . . . . 73.24 110.962 -175.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.607 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.53 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 64.34 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.53 108.823 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.4 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 52.31 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.11 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.32 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.04 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 42.54 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.607 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.01 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.32 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.03 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.12 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.425 ' HA ' HD13 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.42 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.01 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.55 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.22 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.03 111.273 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.34 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 64.1 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.699 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.44 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.15 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.41 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.54 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.688 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.31 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.42 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.55 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.11 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.34 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.461 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.21 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.53 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 73.24 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.44 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.15 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.22 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 61.22 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.461 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.14 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.51 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 65.42 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.42 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.31 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.41 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 72.11 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.01 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.13 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.4 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.3 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.31 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.44 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.34 112.199 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.31 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.42 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.21 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.11 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 61.15 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.688 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.1 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.35 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 45.21 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 55.23 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.11 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.13 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.54 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.2 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.14 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.522 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.15 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.55 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.22 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.33 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.53 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.43 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.418 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.21 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.33 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.01 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.35 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.55 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.34 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.41 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.22 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.41 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.52 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.23 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.01 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.44 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.14 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.44 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.688 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.12 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -152.84 -46.84 0.1 Allowed 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.54 109.198 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 69.9 m -155.55 152.45 28.84 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.933 -0.765 . . . . 71.41 108.933 177.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' PHE . . . . . 0.467 ' HB2' ' OG ' ' A' ' 151' ' ' SER . 60.4 t80 -100.76 127.31 47.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.899 0.38 . . . . 72.12 110.833 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.92 118.85 3.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.748 -0.66 . . . . 55.14 109.748 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.54 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.11 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.23 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.21 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 33.12 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.22 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.32 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.21 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' GLN . . . . . 0.581 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.31 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.14 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p -170.66 179.8 3.15 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.23 110.635 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -160.68 -174.06 4.26 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.154 -0.475 . . . . 64.51 109.825 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 . . . . . 0 C--O 1.252 1.203 0 CA-C-O 118.385 -0.817 . . . . 74.44 110.164 177.655 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.1 m80 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.704 0.287 . . . . 72.44 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -87.47 139.85 30.13 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.705 -0.479 . . . . 64.21 109.705 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.45 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.24 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' O ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.41 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.14 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 74.32 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.4 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.79 145.0 40.09 Favored 'Trans proline' 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.21 111.829 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.64 134.67 4.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.117 -0.492 . . . . 73.51 110.506 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.8 mt -151.92 161.91 41.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.14 -0.482 . . . . 72.12 109.771 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 35.7 m -84.72 119.1 72.41 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.484 -0.325 . . . . 74.42 110.303 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -79.45 167.38 21.18 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.219 1.946 . . . . 74.44 111.227 178.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 16' ' ' LEU . 2.2 pp -160.92 152.99 20.01 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.818 0.342 . . . . 72.42 110.936 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.53 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.42 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.04 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.14 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.14 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.15 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.41 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.32 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 55.3 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.03 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.9 26.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.43 109.938 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -76.55 97.1 4.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.52 -0.764 . . . . 60.51 110.523 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.2 p -169.88 142.08 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.151 -0.477 . . . . 54.34 110.419 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -154.98 144.02 20.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.397 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -151.71 95.46 3.26 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.283 -0.417 . . . . 74.11 110.115 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.25 133.68 29.19 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.723 2.282 . . . . 71.15 111.523 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.48 133.81 44.8 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.38 2.053 . . . . 74.04 111.417 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.79 120.7 77.73 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.272 -0.422 . . . . 75.1 110.974 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HB2' ' H ' ' A' ' 36' ' ' VAL . 85.5 Cg_endo -85.26 -144.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.01 2.473 . . . . 72.45 110.7 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 35' ' ' PRO . 18.9 m -75.19 121.1 26.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.261 0.553 . . . . 65.4 109.597 178.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.3 p -85.59 97.2 9.95 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.427 0.632 . . . . 73.31 112.504 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -126.52 149.53 49.32 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.727 -0.669 . . . . 74.12 109.752 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 95.2 80.42 1.51 Allowed Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.467 -0.873 . . . . 72.35 111.617 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -163.46 38.4 0.09 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.428 0.633 . . . . 64.4 109.429 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 57.7 0.22 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.042 -0.981 . . . . 74.14 109.343 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.63 153.0 64.46 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.011 -0.995 . . . . 41.44 110.274 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.44 121.85 9.0 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.618 2.212 . . . . 71.11 112.116 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -81.69 142.46 32.67 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.785 -0.643 . . . . 64.45 110.113 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 91.9 mt -146.7 -176.53 5.23 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.765 -0.457 . . . . 74.11 109.765 -178.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.0 m -159.6 144.55 15.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.952 0.406 . . . . 72.4 110.61 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 21.5 m -102.55 174.42 5.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.958 -0.565 . . . . 72.32 109.97 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.41 90.32 2.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.233 0.539 . . . . 74.23 110.491 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 20.1 m -86.73 93.72 9.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.517 -0.765 . . . . 75.31 110.824 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -167.96 143.55 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 70.51 110.175 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.34 146.68 40.41 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.69 -0.232 . . . . 72.44 110.454 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.03 165.19 28.65 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.439 2.093 . . . . 72.34 110.847 176.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.5 mt -94.7 143.4 26.15 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-O 120.712 0.291 . . . . 72.04 110.734 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.26 127.15 9.64 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.706 2.271 . . . . 32.25 112.319 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.5 p -84.86 161.59 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.512 -0.551 . . . . 75.42 109.512 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.85 156.69 25.47 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.284 -0.265 . . . . 52.33 110.284 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -77.84 157.37 29.93 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.108 -0.496 . . . . 74.44 111.211 -178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.37 149.42 91.37 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 43.51 110.249 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.52 154.64 72.82 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 122.433 2.089 . . . . 52.44 111.789 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.5 162.02 2.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.076 0.465 . . . . 75.11 111.166 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 93' ' ' LEU . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.45 110.527 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.34 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.32 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.43 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.57 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.02 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.15 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.42 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.3 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.44 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.1 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 62.22 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.31 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.15 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.34 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 64.53 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.32 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.13 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.487 HG11 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.31 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.467 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.45 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.43 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.531 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.14 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.34 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.42 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.03 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.51 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.41 HE21 ' HD1' ' A' ' 81' ' ' PHE . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.24 110.336 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.547 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.53 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.02 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 72.33 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.23 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 103' ' ' ILE . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.22 109.464 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.13 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.05 112.437 -172.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.553 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 74.22 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 70.24 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.52 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.15 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.42 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.34 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.43 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 91' ' ' LEU . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.21 108.575 177.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.43 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.422 HD11 HD22 ' A' ' 91' ' ' LEU . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.53 110.633 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.565 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.52 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.34 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.42 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.3 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.54 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.44 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.11 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.21 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.519 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.43 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.44 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.12 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.565 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 64.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.42 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 72.4 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.34 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.22 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.12 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.13 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.12 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.13 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.31 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.34 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.43 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.43 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.1 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.23 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.41 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.24 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.457 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.44 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.51 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.23 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.12 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.44 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.41 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.35 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.21 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.3 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.54 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.23 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.1 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.35 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.51 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.02 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.35 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.45 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.53 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.03 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.23 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 61.43 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.34 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -162.04 -44.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.34 111.463 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 66.5 m -154.47 125.68 7.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.897 0.38 . . . . 74.2 111.042 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -103.57 108.28 19.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.117 -0.492 . . . . 62.41 109.742 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -84.85 145.67 27.71 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.392 -0.367 . . . . 73.5 111.004 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.54 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.14 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.01 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.15 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.31 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.04 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.01 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.44 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.43 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.44 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t -165.29 -166.89 1.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.15 110.093 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.9 p -156.16 -173.06 4.34 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.698 -0.482 . . . . 74.42 109.698 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 169' ' ' ARG . 25.5 mtm180 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.65 -0.69 . . . . 75.01 109.905 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.385 -0.228 . . . . 75.5 110.385 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm -86.02 90.72 8.18 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.106 0.479 . . . . 55.23 110.128 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 60.33 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.42 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.21 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.1 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.67 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.53 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.67 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.22 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.21 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.41 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -70.08 90.7 0.55 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.45 113.118 -177.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.53 153.93 30.87 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 64.31 109.97 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.4 141.79 17.54 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.74 0.305 . . . . 52.33 110.9 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -92.36 121.43 66.47 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.203 -0.453 . . . . 63.33 110.988 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -70.14 -166.97 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.584 2.189 . . . . 62.5 111.153 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -156.07 175.86 13.42 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.582 0.23 . . . . 53.24 110.526 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.51 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.3 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.04 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.02 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.33 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.22 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 53.42 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.04 110.74 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m -90.66 124.05 43.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.53 110.728 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -156.82 118.93 3.89 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.108 0.48 . . . . 72.14 111.292 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.73 158.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.736 -0.665 . . . . 72.4 109.339 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.11 153.9 30.08 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 61.0 110.145 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.6 p -158.47 98.33 1.75 Allowed Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 116.28 -0.418 . . . . 60.42 111.094 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -80.82 157.36 21.08 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.593 2.196 . . . . 64.4 111.709 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.7 163.24 37.78 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 122.499 2.133 . . . . 72.24 111.854 179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.01 129.17 94.04 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.338 -0.392 . . . . 54.13 110.224 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.13 74.43 5.04 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.676 2.251 . . . . 75.12 112.564 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.5 m -85.81 125.84 40.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 116.148 -0.478 . . . . 51.31 110.506 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 18.5 p -90.42 146.79 23.88 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.145 -0.479 . . . . 70.55 110.914 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -68.45 137.85 54.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.493 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.91 162.27 28.67 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 111.035 -0.826 . . . . 72.43 111.035 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -165.84 92.14 0.51 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.843 0.354 . . . . 54.21 110.879 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.17 99.43 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.681 -0.489 . . . . 73.53 109.681 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.3 mtt -145.52 152.36 49.27 Favored Pre-proline 0 C--N 1.315 -0.899 0 N-CA-C 109.232 -0.655 . . . . 53.2 109.232 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.27 119.24 5.17 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 122.784 2.323 . . . . 73.12 111.637 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.5 m -82.34 149.14 27.9 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.876 -0.602 . . . . 74.14 110.429 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 46' ' ' SER . 6.4 tt -151.32 134.8 16.2 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.57 -0.9 . . . . 61.34 108.57 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 45' ' ' LEU . 22.4 m -71.63 89.11 0.98 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 53.03 111.242 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.2 p -101.65 -19.13 15.55 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.032 -0.531 . . . . 73.04 110.216 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.66 39.6 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.89 -0.596 . . . . 64.42 110.574 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -85.52 148.53 25.91 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.195 -0.457 . . . . 71.1 109.975 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -160.82 174.09 14.39 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.948 -0.389 . . . . 74.34 109.948 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -82.0 150.66 65.62 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 116.382 -0.372 . . . . 63.32 111.228 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 94.9 Cg_endo -81.19 166.68 18.32 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.571 2.18 . . . . 64.21 110.43 174.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.19 111.54 25.23 Favored Pre-proline 0 C--N 1.318 -0.788 0 CA-C-O 120.622 0.249 . . . . 74.5 110.401 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 97.8 Cg_endo -85.92 124.52 2.58 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.621 2.214 . . . . 75.32 111.509 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.1 m -80.59 153.34 4.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 120.859 -0.336 . . . . 54.31 111.167 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -167.15 173.61 8.94 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.365 -0.606 . . . . 75.33 109.365 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.7 m 70.93 112.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.767 0.667 . . . . 75.2 110.645 -178.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 115.96 38.5 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.899 -0.592 . . . . 63.42 111.238 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -85.19 -179.91 3.79 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.059 2.506 . . . . 73.04 111.737 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m -78.85 -176.63 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.15 109.811 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.438 HD23 HD11 ' A' ' 93' ' ' LEU . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.43 110.705 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 62.44 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.31 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.3 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 65' ' ' LEU . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 52.04 110.288 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.31 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.45 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.14 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.21 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.45 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.41 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 70.24 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.594 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.01 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.54 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.01 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.44 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 64.41 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.03 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 64.42 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.54 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.53 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.43 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.406 ' OE1' ' HG ' ' A' ' 80' ' ' LEU . 47.8 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.12 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.13 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.24 111.197 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.44 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.11 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 51.55 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.43 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.44 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.52 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.438 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.683 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.04 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.683 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.01 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.42 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.12 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.55 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.54 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.41 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.45 107.809 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.533 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.53 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.3 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.743 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 52.03 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.53 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.32 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.35 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.11 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.22 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.531 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 54.3 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.21 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 63.14 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.03 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 65.02 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.12 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.533 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 61.41 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.21 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.44 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 63.13 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 52.3 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.24 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 51.52 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.24 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.15 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.11 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.13 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.33 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.01 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.11 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.432 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.53 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.41 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 43.02 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.24 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 70.54 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.44 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.24 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.45 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.53 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.4 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.23 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.12 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.23 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.504 HD23 ' HB3' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.52 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.15 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 61.32 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.42 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.15 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 60.12 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.14 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -40.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.11 110.777 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 62.1 p -162.17 -66.04 0.05 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.916 0.389 . . . . 75.41 110.303 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -141.52 142.01 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.538 -0.541 . . . . 73.31 109.538 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.34 139.62 27.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.852 0.358 . . . . 63.24 110.553 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.45 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.23 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 62.34 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' GLN . . . . . 0.453 ' OE1' ' HA ' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.22 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.01 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.34 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.23 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.51 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.42 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.21 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m -159.52 173.92 15.43 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.41 109.148 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.9 m -156.01 147.79 23.02 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.082 -0.34 . . . . 24.11 110.082 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.556 -0.735 . . . . 74.32 110.199 179.264 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 110.124 -0.325 . . . . 73.31 110.124 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -77.23 160.41 28.94 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.863 -0.791 . . . . 74.14 108.863 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.42 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.52 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.45 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.41 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.44 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.3 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.32 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.33 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.09 102.89 0.33 Allowed 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.23 111.665 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 112.76 0.82 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.651 -0.704 . . . . 40.24 110.256 -178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.81 23.51 0.68 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.994 -0.548 . . . . 62.1 109.877 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 t -82.36 130.71 58.26 Favored Pre-proline 0 N--CA 1.438 -1.056 0 CA-C-N 116.028 -0.533 . . . . 52.32 110.219 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.66 -16.21 30.18 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.803 2.335 . . . . 70.53 111.766 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt -77.74 101.22 6.57 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.906 -0.588 . . . . 53.31 110.503 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.14 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.13 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.31 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.42 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.03 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.22 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.21 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.43 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.1 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.45 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -150.92 92.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.14 110.37 178.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -89.5 157.26 18.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.669 -0.696 . . . . 73.24 111.919 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 p -161.19 116.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.636 -0.711 . . . . 73.13 110.115 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.06 149.24 17.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.203 -0.453 . . . . 63.23 109.868 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 p -152.91 108.77 2.68 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-O 120.708 0.29 . . . . 72.0 110.975 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -74.84 147.82 35.21 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 122.508 2.139 . . . . 63.54 111.819 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.44 175.33 10.23 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.61 2.207 . . . . 74.02 111.877 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.99 117.8 57.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.304 -0.407 . . . . 34.04 111.454 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -82.59 62.94 7.99 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.894 2.396 . . . . 70.43 111.588 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.63 160.87 3.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.928 -0.578 . . . . 73.11 111.205 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.9 m -149.5 133.15 16.8 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.269 -0.423 . . . . 75.0 109.888 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -116.45 168.42 10.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.165 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 161.84 136.46 2.0 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.764 -0.732 . . . . 72.14 111.905 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.33 154.65 8.77 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.804 0.335 . . . . 62.51 111.39 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.83 145.39 2.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 60.4 109.436 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 70.8 mtm -148.39 116.18 3.97 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-O 120.769 0.318 . . . . 73.43 111.102 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.24 -174.92 2.45 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 122.766 2.311 . . . . 64.34 111.618 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 t -153.23 -179.08 7.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.082 -0.34 . . . . 62.13 110.082 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 46' ' ' SER . 3.1 tm? -154.96 137.17 14.81 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.831 -0.803 . . . . 43.01 108.831 -178.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.482 ' N ' HD13 ' A' ' 45' ' ' LEU . 17.4 t -161.57 113.28 1.76 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.685 -0.487 . . . . 74.53 109.685 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 t -118.89 144.29 46.49 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.095 -0.502 . . . . 72.43 110.706 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.77 28.52 0.22 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.447 -0.797 . . . . 41.41 109.199 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.3 m -146.69 164.36 32.94 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.458 -0.792 . . . . 53.1 108.968 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 75.17 12.59 3.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.385 0.674 . . . . 72.13 110.399 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -85.92 117.69 69.17 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.275 -0.875 . . . . 73.03 110.128 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 34.1 Cg_exo -60.42 132.63 44.59 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.404 2.069 . . . . 72.23 111.342 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.56 103.22 17.46 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.717 -0.475 . . . . 73.41 109.717 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 4.9 Cg_exo -77.39 178.67 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.729 2.286 . . . . 72.31 112.41 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.4 t 68.59 108.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 115.424 -0.807 . . . . 60.31 111.432 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.66 21.53 0.06 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.771 -0.65 . . . . 53.1 110.605 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.1 m -156.63 123.14 5.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.284 -0.416 . . . . 70.22 110.861 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.14 126.8 92.54 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 116.1 -0.5 . . . . 73.34 110.332 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.99 177.64 8.48 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.557 2.171 . . . . 63.32 111.744 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m -84.69 172.06 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.472 -0.331 . . . . 65.14 110.198 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 72.41 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.31 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 52.35 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.14 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.2 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.22 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 41.35 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.31 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.13 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.21 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.41 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.436 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.03 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 40.42 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 50.4 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.35 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.15 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.04 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.15 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 61.22 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 54.2 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.04 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.54 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.45 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.43 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.22 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.44 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.44 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.53 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 52.23 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.43 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.55 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 101' ' ' VAL . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.22 111.461 -177.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.586 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.13 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.586 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.24 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.23 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.42 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.4 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.32 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.42 109.274 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.24 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.1 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 62.13 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 62.41 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.44 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.32 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.34 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.11 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.21 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.445 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.01 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.34 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.509 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 63.45 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.04 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.532 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.1 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.436 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.44 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.32 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.45 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.04 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.53 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.24 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.21 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.21 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.22 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.44 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.31 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.31 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.44 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.34 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 52.45 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.505 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.35 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.4 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.44 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.53 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.4 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.464 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.43 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 63.32 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.34 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.33 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.41 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.44 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.31 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.21 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.52 110.837 -178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 42.31 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 73.43 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.32 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.14 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 51.42 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 64.85 85.57 0.14 Allowed 'General case' 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.3 t 70.98 -81.96 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.043 -0.981 . . . . 64.53 112.572 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -127.79 151.36 49.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 70.42 111.381 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.9 80.94 0.71 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.866 -0.606 . . . . 64.41 110.326 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.14 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.52 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 52.02 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.11 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 42.25 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.14 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 41.34 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -73.75 160.93 30.8 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.11 109.437 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 63.5 m -157.53 152.13 25.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.89 0.376 . . . . 52.2 110.965 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.375 -0.822 . . . . 50.21 110.067 179.504 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.3 p80 . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.202 -0.296 . . . . 73.44 110.202 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -103.47 165.31 11.11 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.594 -0.521 . . . . 72.33 109.594 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.42 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.34 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.42 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.54 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 52.01 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.23 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -61.06 145.11 99.4 Favored 'Trans proline' 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.33 112.074 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.45 156.21 16.01 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.827 -0.624 . . . . 52.2 109.709 -179.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.453 ' N ' HD13 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -151.95 173.31 15.0 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.844 0.354 . . . . 71.14 111.519 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.0 m -82.74 119.59 74.79 Favored Pre-proline 0 N--CA 1.441 -0.885 0 N-CA-C 109.469 -0.567 . . . . 34.11 109.469 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.33 105.48 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.228 2.619 . . . . 72.5 113.102 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' H ' HD23 ' A' ' 16' ' ' LEU . 0.5 OUTLIER -83.29 -16.07 47.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.968 -0.56 . . . . 63.35 110.943 178.767 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 64.33 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.34 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.52 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.2 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.52 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.13 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.55 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.51 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p -90.2 105.99 16.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.22 109.318 175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -79.89 105.52 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.279 0.561 . . . . 72.43 111.644 -176.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.3 m -112.27 138.03 42.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.663 -0.698 . . . . 63.21 109.931 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.1 t70 70.97 136.71 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.235 0.614 . . . . 73.32 111.898 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.0 p -153.59 92.37 3.17 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.946 -0.57 . . . . 75.32 110.165 178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -87.57 148.05 7.37 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.001 2.467 . . . . 64.1 112.831 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.22 144.84 42.53 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.306 2.004 . . . . 63.44 110.985 177.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -73.3 116.77 54.31 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.391 -0.368 . . . . 53.44 110.703 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 22.9 Cg_exo -65.33 122.94 10.79 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.519 2.146 . . . . 74.32 111.016 178.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -141.97 138.73 30.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 110.136 -0.32 . . . . 75.22 110.136 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.7 t -145.12 143.33 30.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.487 -0.324 . . . . 62.22 110.171 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -125.9 157.23 38.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.331 -0.395 . . . . 61.51 110.188 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.23 136.76 4.05 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.773 -0.727 . . . . 34.42 112.287 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.71 126.73 1.3 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.867 -0.42 . . . . 64.33 109.867 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.04 -51.07 35.09 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.46 -0.337 . . . . 75.14 110.204 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 47.9 ttm 62.2 92.47 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 115.548 -0.751 . . . . 73.12 111.636 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.46 139.06 12.64 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.351 2.034 . . . . 73.23 112.063 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.0 t -82.6 -26.22 32.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.931 -0.396 . . . . 61.24 109.931 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.8 mt 67.75 172.55 0.27 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.539 -0.755 . . . . 75.24 111.716 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 m -76.5 145.9 38.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.905 -0.589 . . . . 63.33 110.75 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -80.67 159.42 25.32 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.582 -0.525 . . . . 74.24 109.582 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -152.2 12.61 0.57 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 111.868 0.321 . . . . 50.21 111.868 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -82.94 97.89 8.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.261 0.553 . . . . 72.41 109.805 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.17 137.59 43.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.412 -0.813 . . . . 74.55 111.137 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 pt20 -87.15 118.59 70.2 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 116.169 -0.469 . . . . 71.2 110.689 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.43 166.24 9.85 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.935 2.423 . . . . 62.42 112.308 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.56 118.43 70.01 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.192 -0.458 . . . . 73.05 110.481 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.3 116.15 3.43 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.808 2.338 . . . . 34.15 112.066 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.6 m -83.63 140.32 16.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 116.139 -0.482 . . . . 75.15 110.971 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.48 -30.66 66.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.057 -0.519 . . . . 72.34 110.444 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.8 m -157.2 148.52 21.98 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.856 -0.611 . . . . 64.12 110.03 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 147.91 97.58 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.207 -0.451 . . . . 52.22 111.021 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.22 148.14 34.05 Favored 'Trans proline' 0 C--O 1.24 0.588 0 C-N-CA 122.724 2.282 . . . . 70.3 112.567 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.24 170.54 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.087 -0.708 . . . . 62.45 109.087 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 72.41 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.34 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 61.21 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.35 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 123' ' ' VAL . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.54 110.633 -175.155 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.42 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 43.5 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.31 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.11 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.548 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 73.01 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.03 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.33 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.22 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.496 ' O ' HG23 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.12 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 34.32 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.1 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.35 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.2 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.41 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 52.24 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.01 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.41 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.03 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.24 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.54 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.03 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.34 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.593 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.42 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.32 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.8 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.51 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 61.21 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.24 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.541 HD12 HG21 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.03 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.504 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 70.13 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.504 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.41 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.45 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.31 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 HD22 ' HG2' ' A' ' 119' ' ' PRO . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.31 111.345 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.33 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.33 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.541 HG21 HD12 ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 73.54 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.549 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.11 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.623 HD11 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.03 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.42 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.01 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.54 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.45 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.05 108.419 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.623 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 54.15 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.13 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 145' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 72.02 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.43 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.32 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.34 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.468 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.14 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.2 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.14 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.01 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.469 HG13 HD21 ' A' ' 65' ' ' LEU . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.3 109.176 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.32 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.32 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.41 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.41 109.693 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.41 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.34 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.24 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 65.41 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.24 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.33 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.41 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.12 110.542 178.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.14 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.45 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.4 HD12 HD22 ' A' ' 145' ' ' LEU . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.3 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 54.13 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.12 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.05 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.45 110.186 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 114' ' ' LEU . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.02 109.803 177.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.44 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.44 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.21 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.22 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.4 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.02 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.1 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 72.79 132.12 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 61.4 111.121 -179.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 31.4 m -76.73 101.42 5.79 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.953 -0.567 . . . . 61.43 110.687 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -83.7 139.87 32.49 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.396 . . . . 62.54 110.172 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.26 89.36 6.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.057 0.456 . . . . 52.2 110.355 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.12 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.53 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.05 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.44 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.23 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.22 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 30.55 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.43 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.22 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 64.41 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p -167.63 179.56 4.8 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.12 110.451 -177.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 p -159.37 178.12 10.27 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.1 -0.333 . . . . 72.13 110.1 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.585 -0.722 . . . . 75.13 110.238 179.769 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 110.314 -0.254 . . . . 72.31 110.314 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? 69.52 155.32 0.13 Allowed 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.753 0.658 . . . . 72.34 112.191 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.11 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 43.31 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.24 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 51.4 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.2 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 54.22 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.41 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.78 155.92 61.65 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.43 111.672 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.36 112.81 12.04 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.189 -0.46 . . . . 75.25 110.971 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.09 150.02 25.83 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 110.12 -0.326 . . . . 70.53 110.12 177.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 p -87.56 155.19 53.86 Favored Pre-proline 0 C--N 1.31 -1.151 0 CA-C-N 116.223 -0.444 . . . . 54.14 109.914 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -58.14 119.58 6.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 C-N-CA 122.445 2.097 . . . . 41.24 111.294 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.6 pt? -71.57 145.65 48.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.613 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 64.13 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.33 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.23 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.13 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.21 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.02 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.14 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 61.35 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 53.52 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.13 110.884 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.42 159.67 2.86 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.22 108.55 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -153.03 115.3 4.4 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 119.415 -0.914 . . . . 63.22 112.505 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -151.66 97.74 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 114.951 -1.022 . . . . 62.21 109.281 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -148.76 133.06 17.47 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.771 -0.65 . . . . 73.11 109.922 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.1 p -157.05 137.19 8.82 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 116.009 -0.541 . . . . 61.13 110.31 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.91 123.75 13.9 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.553 2.168 . . . . 54.4 111.578 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.74 118.87 4.86 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.029 2.486 . . . . 54.4 112.161 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.34 129.74 88.58 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.769 -0.651 . . . . 61.54 110.844 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 179.58 4.68 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.597 2.198 . . . . 74.24 112.196 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.53 114.26 22.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.49 0.662 . . . . 72.13 110.815 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 15.2 t -89.78 -19.93 24.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.972 -0.558 . . . . 43.52 110.33 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -71.55 128.82 37.09 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.205 -0.452 . . . . 73.15 110.046 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.07 -171.79 43.33 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.712 -0.756 . . . . 71.11 112.882 -178.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.62 -168.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.489 -0.56 . . . . 64.41 109.489 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.76 -169.19 2.0 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.104 -0.332 . . . . 74.44 110.104 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.1 tpt -139.09 102.16 7.55 Favored Pre-proline 0 C--N 1.317 -0.839 0 CA-C-O 120.824 0.345 . . . . 74.12 110.822 -178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.53 111.07 3.23 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.759 2.306 . . . . 74.54 111.061 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.8 t -151.28 152.7 33.59 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.287 -0.415 . . . . 72.33 110.22 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 tp -159.68 166.24 30.99 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.743 -0.836 . . . . 73.33 108.743 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.7 m -157.89 88.36 0.97 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 71.13 110.119 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 p -113.04 152.15 29.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.625 -0.716 . . . . 74.42 110.02 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -157.22 92.32 1.24 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.441 0.638 . . . . 64.13 110.383 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.2 m -151.47 98.43 2.51 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.581 -0.736 . . . . 62.35 110.227 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.2 174.65 9.18 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.707 -0.679 . . . . 62.12 110.088 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -77.81 114.82 44.91 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 109.946 -0.391 . . . . 64.02 109.946 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.36 106.0 0.79 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.539 2.159 . . . . 75.4 111.229 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.3 mt -114.34 105.53 53.78 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.254 -0.43 . . . . 71.42 110.639 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.72 146.94 27.21 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.421 2.08 . . . . 71.42 111.216 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.5 m -80.36 81.97 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.783 0.801 . . . . 75.41 110.573 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.92 165.41 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.155 -0.929 . . . . 22.13 109.583 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.6 m -75.9 165.31 25.18 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.354 -0.384 . . . . 71.22 110.574 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.59 133.62 94.26 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.165 -0.47 . . . . 74.34 110.88 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -84.64 164.07 12.31 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.711 2.274 . . . . 74.24 111.898 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m -91.41 164.75 2.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.506 -0.553 . . . . 44.12 109.506 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.42 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.04 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.14 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.04 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.44 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 54.24 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.32 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 72.32 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.55 111.143 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.12 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 71.11 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 78' ' ' VAL . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 64.21 109.135 176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.13 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.14 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.52 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 74' ' ' PHE . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 64.34 110.879 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.477 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 55.23 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.52 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 86' ' ' GLN . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.14 111.484 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.45 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.41 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.2 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.44 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' PHE . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.04 109.713 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.3 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 63.13 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.15 112.842 -177.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.42 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.44 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.2 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.45 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.513 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.33 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.513 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 64.02 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.448 HD12 ' HG3' ' A' ' 97' ' ' GLU . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.03 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.21 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.41 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.41 110.222 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 71.54 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 64.1 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.439 HD11 ' HB1' ' A' ' 112' ' ' ALA . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.13 110.91 -177.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.44 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.464 HD11 HD13 ' A' ' 143' ' ' ILE . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.44 111.063 -172.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.53 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.12 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.41 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.21 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.51 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.554 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.3 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.43 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 65.41 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 65.54 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.02 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.23 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.425 ' OG ' HG22 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.41 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.24 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.425 HG22 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.23 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.526 ' HD3' HG21 ' A' ' 150' ' ' ILE . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.41 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.12 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 55.51 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.21 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.34 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.622 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.33 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.4 112.587 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.11 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.622 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 63.43 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.42 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.54 111.745 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 71.13 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.02 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.22 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.42 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.44 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.41 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.464 HD13 HD11 ' A' ' 107' ' ' LEU . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.15 110.768 -179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.14 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 64.15 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.41 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.43 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.23 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.436 ' HB2' ' HA ' ' A' ' 115' ' ' GLN . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.34 109.529 176.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.526 HG21 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.43 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.11 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.82 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.51 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 174.32 -31.34 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.21 106.384 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.2 m -158.84 165.02 35.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 113.766 -1.561 . . . . 53.32 106.91 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -125.02 141.26 52.24 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.97 -0.692 . . . . 64.3 111.588 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.61 158.38 33.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.342 -0.844 . . . . 74.23 109.573 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.33 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 62.42 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.52 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.42 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.13 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.42 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 64.44 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.04 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.12 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m -162.58 135.88 5.99 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 40.34 109.983 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 m -157.87 163.41 37.97 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.476 -0.564 . . . . 54.1 109.476 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.313 -1.003 0 CA-C-O 118.545 -0.74 . . . . 73.43 110.242 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 110.234 -0.284 . . . . 73.15 110.234 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt -99.29 32.77 2.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.04 0.447 . . . . 62.24 110.662 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.21 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 64.1 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.12 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.32 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.413 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.42 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.41 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 61.32 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.12 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.71 -168.73 0.51 Allowed 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.51 111.954 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.77 149.93 11.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.872 -0.604 . . . . 72.13 109.391 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -156.64 153.5 28.66 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.078 -0.342 . . . . 74.23 110.078 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.418 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 9.9 t -85.99 133.51 41.02 Favored Pre-proline 0 C--N 1.307 -1.248 0 CA-C-N 116.551 -0.295 . . . . 51.52 110.289 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 14' ' ' THR . 31.8 Cg_exo -61.31 132.41 41.09 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.372 2.048 . . . . 74.32 111.047 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -77.31 84.96 3.75 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.872 0.367 . . . . 63.33 111.091 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.1 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 74.52 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.15 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.55 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.32 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.11 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.53 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.13 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.44 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.42 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -150.58 103.33 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.12 109.891 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -82.41 100.23 9.89 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.697 -0.683 . . . . 75.21 110.594 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.5 p -125.06 141.92 43.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.982 -0.554 . . . . 72.01 110.37 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -155.1 -23.06 0.12 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.07 0.462 . . . . 62.25 110.675 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -146.81 85.68 6.98 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.048 0.452 . . . . 70.41 110.425 178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -81.36 165.53 18.64 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.093 2.529 . . . . 74.11 112.113 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -67.11 140.52 54.31 Favored 'Trans proline' 0 C--O 1.241 0.651 0 C-N-CA 122.622 2.214 . . . . 65.13 112.387 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.38 149.08 98.17 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.821 -0.627 . . . . 63.34 110.86 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.51 51.5 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.063 2.509 . . . . 53.15 112.648 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.8 m -84.17 136.07 23.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 116.112 -0.494 . . . . 64.44 110.656 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.7 m 56.05 79.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.382 0.611 . . . . 71.13 110.685 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -112.34 109.86 19.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.961 -0.563 . . . . 75.51 111.205 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.96 141.25 15.21 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.935 -0.65 . . . . 75.0 111.601 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.78 172.5 8.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.799 0.333 . . . . 75.43 111.055 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.62 140.38 9.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.199 -0.455 . . . . 75.51 110.396 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 24.0 ptp -157.07 144.06 13.53 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.88 -0.6 . . . . 64.43 109.882 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 42' ' ' MET . 4.5 Cg_exo -74.94 117.41 4.91 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.43 2.087 . . . . 73.53 111.724 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -87.62 -31.53 19.77 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.133 0.492 . . . . 71.51 110.648 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.97 -164.6 0.9 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.619 -0.719 . . . . 73.25 110.549 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.3 m 71.47 26.31 3.26 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.094 0.558 . . . . 72.04 111.797 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.9 t -125.09 101.46 7.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.078 0.466 . . . . 62.45 110.643 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.37 -27.7 46.96 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.994 -0.548 . . . . 71.24 109.846 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.1 m 55.62 69.29 0.75 Allowed 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.48 -0.782 . . . . 73.41 110.846 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.1 151.81 10.48 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.48 -0.782 . . . . 72.22 109.963 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' CD ' ' H ' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -81.53 138.04 47.93 Favored Pre-proline 0 C--N 1.311 -1.086 0 CA-C-N 116.465 -0.334 . . . . 74.31 110.265 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 39.2 Cg_exo -61.1 105.78 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.343 2.029 . . . . 74.12 111.064 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.473 HD12 ' O ' ' A' ' 53' ' ' LEU . 3.8 pp -76.35 138.43 67.78 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.181 -0.463 . . . . 52.14 111.417 -178.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.21 175.56 9.76 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.467 2.112 . . . . 73.05 111.78 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -140.14 173.32 10.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.977 -0.556 . . . . 74.12 109.835 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.08 -171.66 2.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.681 0.276 . . . . 64.31 110.777 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 t -73.26 158.94 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.88 -0.6 . . . . 70.12 109.77 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.35 125.9 91.77 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.297 -0.411 . . . . 41.01 111.56 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.05 -179.36 4.92 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 123.198 2.598 . . . . 70.24 111.333 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m -75.83 154.09 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.425 HD23 HD11 ' A' ' 93' ' ' LEU . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.14 111.182 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.31 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.15 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.53 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.4 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.05 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.13 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.42 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.53 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.11 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.12 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 71.12 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.22 111.03 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.03 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.41 ' NE2' HD12 ' A' ' 91' ' ' LEU . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.41 112.491 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.405 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.13 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.515 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.21 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.12 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.32 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 70.12 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.55 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.42 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 63.42 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.24 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.34 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.24 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.41 HD12 ' NE2' ' A' ' 77' ' ' GLN . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.1 110.125 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.15 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.32 112.488 -175.378 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.647 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 89.3 m-70 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.647 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.41 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.34 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.12 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.13 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.55 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.34 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.33 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.53 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.13 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.01 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.598 HD11 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.14 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.54 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.23 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.32 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.04 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.44 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.02 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.598 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.1 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.43 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.02 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.41 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.468 ' SD ' HD11 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.42 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.33 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.12 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.15 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.0 m80 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.15 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.51 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 72.41 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.33 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 45.24 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 32.01 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.13 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.468 HD11 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.02 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.15 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.563 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.2 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 62.14 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.02 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.563 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.2 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.559 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.23 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.11 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.35 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.13 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.44 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.35 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.04 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.22 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.31 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.22 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.14 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.33 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.03 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 64.05 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 63.01 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.1 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.12 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.12 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -160.33 -42.88 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.03 109.607 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 32.3 p -155.86 166.08 34.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.65 -0.705 . . . . 73.42 109.235 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -82.51 117.83 22.81 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.83 0.347 . . . . 74.32 110.674 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.95 110.41 17.19 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.101 -0.5 . . . . 51.4 110.706 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.51 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.03 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.21 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' GLN . . . . . 0.434 ' CD ' ' H ' ' A' ' 160' ' ' GLN . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.31 111.323 -178.199 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.15 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 43.32 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.33 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.52 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.2 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.24 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m -160.18 17.99 0.15 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.52 110.476 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 61.8 p -164.52 160.29 20.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.447 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 . . . . . 0 C--N 1.316 -0.864 0 CA-C-O 118.431 -0.795 . . . . 71.32 109.756 177.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 50.4 m80 . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.901 0.381 . . . . 73.21 110.657 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -131.58 151.45 51.59 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.211 -0.45 . . . . 74.31 109.975 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.05 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.34 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.23 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.21 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.32 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.52 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 70.32 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.15 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -83.17 -161.43 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.12 111.505 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.48 149.24 15.08 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.337 -0.392 . . . . 75.33 110.075 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.6 mt -150.23 141.48 23.2 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.107 -0.497 . . . . 52.22 109.971 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 p -86.38 143.06 35.96 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.933 -0.576 . . . . 72.32 110.714 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.31 112.68 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.552 2.168 . . . . 73.13 111.368 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -151.0 103.99 3.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.015 0.436 . . . . 64.01 110.705 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 71.21 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.34 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.01 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.42 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.22 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.11 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.43 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.41 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.42 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.12 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.43 113.88 29.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.31 110.754 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -158.18 109.57 2.22 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.926 -0.579 . . . . 72.32 109.716 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -114.65 170.7 4.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 116.356 -0.384 . . . . 74.4 111.305 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -161.01 102.91 1.29 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.689 -0.687 . . . . 65.52 109.356 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -83.11 118.7 72.47 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.999 -0.546 . . . . 73.15 111.591 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -85.25 132.19 4.38 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.592 2.194 . . . . 75.24 111.949 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.44 130.91 35.69 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.493 2.129 . . . . 65.03 111.67 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.47 121.08 83.89 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.511 . . . . 73.14 111.123 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.82 170.05 20.57 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.523 2.149 . . . . 71.15 111.932 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.8 p -88.59 130.92 37.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.266 -0.424 . . . . 71.23 110.406 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.7 t -87.69 147.86 25.04 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.432 -0.349 . . . . 72.21 110.431 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 -120.73 169.12 10.7 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.373 -0.376 . . . . 75.04 110.207 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 137.65 128.1 2.62 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.38 -0.914 . . . . 61.24 112.556 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 139.37 4.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.956 -0.387 . . . . 53.15 109.956 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.66 161.5 18.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.835 0.35 . . . . 75.43 111.153 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.9 tpt -159.5 85.57 2.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.779 -0.646 . . . . 75.45 109.306 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -76.99 119.53 5.12 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.805 2.337 . . . . 71.01 112.885 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 t -157.92 113.48 2.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.51 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -154.99 119.33 4.71 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.206 -0.452 . . . . 72.11 111.112 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 m 67.24 161.5 0.17 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.963 0.727 . . . . 32.43 112.963 176.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -98.35 -37.77 9.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.724 -0.671 . . . . 72.14 109.272 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 69.92 132.91 0.03 OUTLIER 'General case' 0 C--N 1.35 0.609 0 C-N-CA 124.008 0.923 . . . . 70.2 112.027 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.7 m -85.02 99.12 10.81 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.104 0.478 . . . . 72.4 110.082 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.12 -20.24 59.52 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.798 -0.637 . . . . 40.25 111.167 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -79.57 126.21 81.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.198 -0.456 . . . . 74.3 110.927 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.37 166.89 28.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.921 2.414 . . . . 63.44 111.654 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 74.6 mt -112.37 101.54 52.48 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-O 120.89 0.376 . . . . 75.41 110.543 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HB2' ' H ' ' A' ' 55' ' ' VAL . 71.9 Cg_endo -88.66 -149.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.184 2.589 . . . . 71.44 111.812 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.402 ' H ' ' HB2' ' A' ' 54' ' ' PRO . 4.0 p -150.39 93.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.738 0.78 . . . . 75.01 110.161 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.89 116.59 10.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.258 -0.883 . . . . 73.24 111.198 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.2 m 60.24 79.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.504 -0.771 . . . . 71.12 111.948 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.89 131.35 81.71 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.886 -0.597 . . . . 44.52 110.47 178.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.23 178.9 7.07 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.765 2.31 . . . . 61.42 111.517 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.88 166.38 2.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 121.001 0.429 . . . . 73.41 110.317 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.549 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 53.34 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.24 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.51 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 64.12 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.54 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.23 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.2 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.42 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.43 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.549 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.05 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 53.14 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.2 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.24 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.23 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 55.54 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.24 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.673 HE22 HD13 ' A' ' 91' ' ' LEU . 49.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.52 111.161 179.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.14 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.34 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.42 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.3 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 42.24 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 72.52 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.11 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.23 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.41 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 61.41 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.34 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.511 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.33 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.673 HD13 HE22 ' A' ' 77' ' ' GLN . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.52 111.901 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 62.33 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.14 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.453 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.04 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.453 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.41 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.01 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.12 110.372 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.33 110.933 176.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.52 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.13 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 53.42 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 73.51 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.24 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.03 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 74.52 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.34 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.14 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.24 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.52 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.51 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.522 ' HB3' HD23 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.41 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.12 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.05 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.12 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.403 ' HG3' HG13 ' A' ' 103' ' ' ILE . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.1 108.695 -176.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 60.14 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 44.44 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.52 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 61.43 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.41 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.51 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.03 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.41 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.54 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.35 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.12 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.05 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.12 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.52 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.35 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 61.51 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 71.43 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.44 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.418 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 84.5 mm-40 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.33 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.23 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.23 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.42 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.33 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.52 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.12 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.522 HD23 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.23 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.01 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 50.6 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.44 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.03 110.384 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.02 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.34 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.13 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.22 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -165.69 -37.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.955 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 22.7 t -150.29 -163.91 1.89 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.144 -0.687 . . . . 74.12 109.144 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -78.42 145.31 35.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.639 -0.504 . . . . 63.4 109.639 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.06 139.04 14.39 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.816 0.341 . . . . 75.32 110.771 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.11 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.1 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.12 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.41 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 54.3 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.41 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.41 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.42 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p -167.07 155.58 9.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.41 111.52 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 50.5 m -157.8 170.67 21.84 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.223 -0.658 . . . . 54.33 109.223 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.347 -0.835 . . . . 73.22 110.035 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 120.654 0.264 . . . . 75.45 110.756 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp -75.46 114.26 13.8 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.193 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.45 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 63.1 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.33 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.44 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.22 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.31 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 65.34 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 11' ' ' PRO . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.4 112.537 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 10' ' ' GLY . 94.8 Cg_endo -92.13 166.72 3.05 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.45 112.098 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.92 165.7 24.44 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.855 -0.612 . . . . 65.33 111.058 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.03 156.51 29.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.223 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.1 p -84.05 152.12 61.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 116.541 -0.3 . . . . 75.53 110.582 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -61.8 125.1 15.84 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.624 2.216 . . . . 73.41 111.797 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.05 110.59 9.48 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.345 -0.389 . . . . 71.52 110.519 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.15 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.12 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.44 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.1 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.21 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.51 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.11 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.54 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.51 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p -152.54 147.0 15.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.53 110.434 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -156.39 106.23 2.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.238 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -138.51 109.85 5.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.402 0.62 . . . . 73.43 111.343 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -162.68 158.86 23.67 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 72.13 109.709 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 23.2 t -156.9 121.52 2.35 Favored Pre-proline 0 C--N 1.317 -0.835 0 N-CA-C 109.944 -0.391 . . . . 64.35 109.944 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 31' ' ' SER . 26.5 Cg_exo -64.02 115.42 3.11 Favored 'Trans proline' 0 C--O 1.24 0.582 0 C-N-CA 123.005 2.47 . . . . 51.11 112.195 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.97 124.37 2.14 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.534 2.156 . . . . 75.24 111.964 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.54 120.07 79.23 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.183 -0.462 . . . . 53.23 110.835 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.37 118.08 5.46 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.495 2.13 . . . . 53.43 112.136 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.1 -18.64 8.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.243 -0.435 . . . . 70.1 110.939 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 p -87.81 117.62 26.77 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.059 -0.519 . . . . 42.5 110.489 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.4 m80 -126.41 110.01 12.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.792 0.329 . . . . 74.41 110.696 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -129.77 72.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.478 -0.649 . . . . 55.21 111.478 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.48 -175.48 3.9 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.634 -0.506 . . . . 64.33 109.634 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 52.8 68.91 0.76 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.303 0.573 . . . . 51.42 111.007 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.9 mtm -144.62 117.77 5.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.867 -0.606 . . . . 73.15 110.176 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -78.76 155.82 27.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.73 2.287 . . . . 74.31 112.338 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.5 t -160.8 146.94 14.93 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 116.11 -0.495 . . . . 52.23 110.189 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt 62.03 -166.58 0.21 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.144 0.578 . . . . 72.15 111.848 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.7 t -165.55 102.69 0.71 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.01 -0.541 . . . . 75.11 109.634 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.2 m -116.73 162.74 17.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.273 -0.421 . . . . 71.2 110.891 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.99 149.76 14.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.895 -0.593 . . . . 74.03 109.853 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.86 106.09 3.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.979 0.419 . . . . 61.11 111.388 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.63 88.38 0.41 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 74.03 109.57 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -85.51 114.29 55.65 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.65 -0.704 . . . . 65.24 111.822 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.91 107.01 1.98 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.434 2.09 . . . . 74.15 110.748 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.4 mt -101.39 121.26 52.25 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.33 -0.396 . . . . 64.21 111.283 -177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.57 159.12 16.77 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.571 2.181 . . . . 62.02 111.395 177.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t 72.68 143.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.147 0.579 . . . . 74.04 111.342 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -162.72 138.33 7.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.278 -0.419 . . . . 71.33 110.724 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.415 ' O ' ' HD3' ' A' ' 59' ' ' PRO . 48.4 t -161.73 147.29 13.52 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.627 -0.879 . . . . 61.22 108.627 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.54 112.53 15.33 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 120.766 0.317 . . . . 75.34 111.061 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 57' ' ' SER . 58.3 Cg_endo -101.34 176.6 0.23 Allowed 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 123.281 2.654 . . . . 72.11 111.535 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.27 149.68 3.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 109.002 -0.74 . . . . 43.04 109.002 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 43.12 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.13 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HB1' ' HD2' ' A' ' 64' ' ' PRO . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.413 ' HD2' ' HB1' ' A' ' 63' ' ' ALA . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.53 110.76 176.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.43 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.23 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.41 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.33 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.04 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.01 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.44 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.1 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.684 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.2 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.14 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.4 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.12 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.13 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.13 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.43 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.44 111.757 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.23 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 72.44 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.41 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.21 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 74.31 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 41.55 111.214 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.42 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.13 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.51 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.02 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.4 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.23 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.04 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.34 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 45.2 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.24 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.55 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.2 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.501 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 54.1 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.43 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.53 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.671 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.14 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.11 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.42 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.23 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.12 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.58 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.13 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.671 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.53 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.1 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.426 ' CD2' HD22 ' A' ' 145' ' ' LEU . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.13 111.519 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.11 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.43 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.572 HG13 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.44 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.22 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.14 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.23 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.44 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.33 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.52 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.35 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 52.53 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.45 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.42 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.44 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.41 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.426 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.24 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.51 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.42 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.41 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 55.31 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.14 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.03 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.34 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 43.15 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.52 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.03 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.15 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.41 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.58 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 62.45 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 114' ' ' LEU . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.32 110.044 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.41 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.464 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.52 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.23 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 55.24 112.265 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.15 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.572 ' H ' HG13 ' A' ' 117' ' ' VAL . 37.2 mt-10 67.16 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.24 111.647 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 23.3 t -96.57 164.61 12.53 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.278 -0.638 . . . . 73.32 109.278 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -78.52 124.89 28.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.951 -0.389 . . . . 72.12 109.951 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.98 121.97 26.69 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.304 -0.407 . . . . 63.35 110.768 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.05 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.43 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.24 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.35 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.13 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 44.22 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.35 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.41 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 13.8 tm0? -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.13 109.654 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 51.31 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m -159.58 164.4 34.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 22.8 t -162.03 -169.39 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.859 -0.423 . . . . 72.02 109.859 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.567 -0.73 . . . . 63.11 110.197 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.4 m80 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 109.935 -0.395 . . . . 75.14 109.935 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm -157.79 157.3 33.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.82 0.343 . . . . 55.1 111.195 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 71.3 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.04 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 55.22 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.13 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.501 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.1 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.501 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.33 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.3 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.34 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.43 147.24 58.11 Favored 'Trans proline' 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.12 111.031 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.88 121.14 18.52 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.455 -0.339 . . . . 63.13 110.451 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.9 124.52 28.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.874 0.369 . . . . 61.51 110.355 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.2 m -81.33 123.61 81.2 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 73.15 110.349 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 176.98 7.43 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.804 2.336 . . . . 74.4 111.982 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.51 169.61 23.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.228 -0.442 . . . . 64.22 110.312 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 65.24 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.53 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.04 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.4 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.23 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.22 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.41 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.43 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.41 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -146.28 133.21 14.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 63.43 108.187 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -151.61 27.67 0.64 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.984 0.421 . . . . 64.3 110.777 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.8 m -131.32 161.59 40.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.895 -0.593 . . . . 75.21 110.751 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.75 -170.81 3.31 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.858 -0.61 . . . . 73.41 109.462 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -79.02 145.76 66.28 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-O 120.7 0.286 . . . . 74.31 110.909 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.61 165.48 18.01 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.766 2.31 . . . . 62.42 111.236 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -49.51 114.1 1.2 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.735 2.29 . . . . 72.33 112.243 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.61 124.18 90.46 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.202 -0.453 . . . . 54.23 110.637 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -60.36 109.23 0.6 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.436 2.09 . . . . 73.54 111.629 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.6 m -86.02 148.96 4.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.604 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 34.6 p -87.88 -38.72 15.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.37 -0.377 . . . . 73.0 111.127 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -126.39 149.36 49.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.347 -0.388 . . . . 72.22 111.14 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.36 -78.14 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 111.441 -0.664 . . . . 75.52 111.441 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 18.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.78 0.324 . . . . 72.44 111.178 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.12 -24.55 59.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.998 0.428 . . . . 51.21 111.082 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -153.8 161.11 30.02 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 109.26 -0.645 . . . . 55.33 109.26 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -46.51 -57.25 2.36 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.808 2.339 . . . . 63.1 112.486 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER 63.58 178.18 0.16 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 116.097 -0.501 . . . . 65.02 110.62 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.565 ' H ' HG22 ' A' ' 44' ' ' THR . 61.0 tp -75.96 151.14 37.33 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.654 -0.499 . . . . 64.1 109.654 177.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t 71.74 -167.13 0.14 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 123.638 0.586 . . . . 72.4 109.769 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 m 67.85 113.76 0.04 OUTLIER 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.083 0.553 . . . . 75.53 110.968 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.78 -161.48 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.208 -0.451 . . . . 54.31 110.689 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.6 m 74.29 -57.31 0.62 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.618 0.767 . . . . 52.11 111.492 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.5 74.43 4.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.991 0.424 . . . . 53.33 110.124 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.414 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 68.2 mt-30 -90.38 140.91 27.07 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 75.32 110.6 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 21.4 Cg_exo -65.62 105.31 0.75 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.945 1.764 . . . . 72.03 110.018 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.8 mt -91.07 141.35 26.37 Favored Pre-proline 0 C--N 1.312 -1.044 0 CA-C-N 116.432 -0.349 . . . . 64.11 111.686 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.35 173.45 14.48 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.798 2.332 . . . . 70.12 111.474 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.4 m -82.8 160.35 3.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 120.734 0.302 . . . . 63.15 110.813 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.16 -165.09 0.36 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.998 -0.546 . . . . 65.42 110.324 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.1 t -72.49 169.75 15.78 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.258 -0.645 . . . . 72.21 109.258 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.38 129.16 92.22 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-O 120.376 0.131 . . . . 73.23 110.913 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.68 125.51 18.18 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.018 2.479 . . . . 54.02 112.612 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -87.25 163.48 2.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.605 -0.725 . . . . 75.11 110.503 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 72.13 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 52.31 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 63.33 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.24 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.34 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.01 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 62.31 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.41 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.456 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.12 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.13 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.11 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 73.15 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.14 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.22 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.11 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.14 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.43 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.51 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.51 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.23 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.44 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.21 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 53.8 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.01 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.32 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.57 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 43.21 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.15 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.416 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.05 109.038 175.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.22 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.52 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 64.14 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.2 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.23 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.33 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.42 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.53 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.21 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.43 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 72.31 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.13 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.22 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.3 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.15 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.24 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.12 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.558 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.12 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.41 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.558 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.42 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.15 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.4 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.41 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.53 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.559 HG13 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 74.54 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.34 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 70.35 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.23 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.43 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.45 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 63.54 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.41 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.13 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.32 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.52 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.51 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 42.52 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.568 ' O ' HG22 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.04 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 64.31 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.21 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.24 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 133' ' ' MET . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.11 110.06 178.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.401 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.44 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 70.22 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.23 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.401 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.32 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.24 110.124 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.34 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.15 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.33 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.03 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.21 109.185 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.33 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.559 ' H ' HG13 ' A' ' 117' ' ' VAL . 42.3 mt-10 69.97 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.23 109.519 -176.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 52.2 m -156.43 25.47 0.35 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.112 -0.699 . . . . 64.02 109.112 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -78.75 110.76 14.21 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.37 -0.832 . . . . 74.31 111.624 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.61 98.09 11.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.842 -0.617 . . . . 73.23 110.051 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.13 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.41 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.33 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 71.23 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.14 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 64.54 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.23 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.14 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.04 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.01 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m -157.71 114.15 2.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 63.15 110.821 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -161.74 129.61 4.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.449 -0.796 . . . . 50.2 110.299 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.457 -0.782 . . . . 70.13 110.246 179.296 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 t60 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.834 0.349 . . . . 75.2 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -89.98 -162.82 0.93 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.209 -0.45 . . . . 65.1 110.118 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.13 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.44 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.613 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.31 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.12 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.613 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.1 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.41 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.04 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -83.31 173.01 10.12 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 34.45 111.852 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 133.07 2.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.471 -0.331 . . . . 73.1 110.854 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 85.3 mt -82.68 141.13 32.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.415 -0.357 . . . . 75.11 110.046 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.3 m -86.63 119.43 71.32 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 116.549 -0.296 . . . . 61.52 110.798 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.71 143.67 18.93 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.361 2.041 . . . . 63.12 110.974 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.84 154.1 23.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.758 0.313 . . . . 72.34 110.448 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.01 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.31 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.41 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.33 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.53 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.21 110.799 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.12 109.231 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.44 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.23 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m -84.51 144.76 9.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 64.33 111.044 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -149.17 90.06 1.71 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.075 -0.511 . . . . 75.23 110.792 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.4 p -113.55 -2.23 10.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.261 0.553 . . . . 75.22 109.614 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 70.34 154.97 0.13 Allowed 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.066 -0.97 . . . . 74.02 111.32 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t 71.65 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.541 -0.754 . . . . 72.54 111.065 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.37 159.04 44.01 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.858 2.372 . . . . 74.52 111.726 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -58.14 126.05 20.39 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.688 2.259 . . . . 63.52 112.101 179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -69.57 129.73 91.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 53.55 110.675 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 28.9 Cg_exo -62.59 140.44 81.31 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.655 2.237 . . . . 62.24 112.274 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.7 t -140.73 133.3 31.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.948 -0.76 . . . . 44.43 108.948 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.1 m -88.67 134.51 33.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.488 -0.324 . . . . 75.32 111.113 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -64.98 156.39 31.42 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.249 -0.432 . . . . 71.52 110.636 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.75 -119.71 4.51 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.962 -0.637 . . . . 50.54 111.521 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.5 -68.24 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 122.264 0.226 . . . . 71.4 110.402 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 46.82 68.75 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.732 0.645 . . . . 75.52 111.416 -178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mtp -150.87 99.81 3.1 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.982 -0.554 . . . . 71.4 110.603 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -63.48 97.05 0.2 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.266 1.978 . . . . 64.13 110.009 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 m -89.31 124.62 34.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.827 -0.624 . . . . 63.54 111.883 -175.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 62.7 tp -82.89 140.09 33.05 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.084 -0.71 . . . . 75.13 109.084 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m -70.45 83.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.36 0.6 . . . . 63.15 110.743 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.3 t -154.48 113.79 3.71 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.302 -0.863 . . . . 73.35 109.302 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.07 152.6 19.23 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.79 -0.641 . . . . 74.14 109.829 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 2.0 t -148.14 96.19 2.59 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.682 0.753 . . . . 72.45 110.259 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.42 175.98 9.46 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.065 -0.97 . . . . 75.22 108.825 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.55 117.78 69.39 Favored Pre-proline 0 C--N 1.311 -1.082 0 C-N-CA 120.886 -0.325 . . . . 75.0 110.187 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.67 126.96 13.3 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.272 2.648 . . . . 74.24 112.21 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.7 mt -96.37 114.09 63.7 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 115.89 -0.596 . . . . 75.54 110.677 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.52 147.93 92.8 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.357 2.038 . . . . 71.12 110.724 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.431 ' O ' HD11 ' A' ' 80' ' ' LEU . 14.2 m -143.23 132.75 21.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.944 0.402 . . . . 75.43 110.891 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -45.6 58.07 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.744 -0.662 . . . . 63.35 110.321 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.2 m -80.2 104.25 10.63 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.816 -0.629 . . . . 72.21 110.862 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 124.34 90.74 Favored Pre-proline 0 C--O 1.239 0.521 0 CA-C-N 115.899 -0.592 . . . . 51.34 110.813 179.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.13 177.11 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.418 2.079 . . . . 64.12 111.624 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m -86.14 159.82 3.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.301 -0.409 . . . . 64.1 109.991 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.34 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.44 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.22 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.21 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.64 ' H ' HD23 ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 65.42 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 55.32 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.12 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.42 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.33 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.53 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.35 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.668 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.04 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.53 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.11 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.1 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.12 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.54 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.541 HD13 ' HD3' ' A' ' 83' ' ' ARG . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.42 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.14 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.05 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' HD13 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.32 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.15 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.31 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 61.35 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.1 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.4 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.4 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.22 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.42 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.04 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.24 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.42 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.01 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.14 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.14 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.03 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.11 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 43.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.555 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 73.24 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.54 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 65.04 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 60.03 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.34 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.35 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.52 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 65.22 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.44 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.13 109.354 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.4 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.489 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.23 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 72.1 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.53 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.22 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.1 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.52 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.43 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.44 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.04 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.41 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.03 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 127' ' ' LEU . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.22 110.347 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.02 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 61.3 111.972 177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.03 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.1 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.23 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 63.21 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.11 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.4 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.21 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.04 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.11 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.04 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.52 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 61.42 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.24 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.34 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.21 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.41 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.12 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.52 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.43 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.43 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -143.06 -46.24 0.3 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.14 108.293 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.9 t -160.96 134.85 6.88 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.253 -1.017 . . . . 62.24 108.253 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -90.2 103.41 16.09 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.818 0.342 . . . . 75.33 110.162 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.88 113.61 2.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.052 -0.522 . . . . 73.53 110.206 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.54 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 33.31 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.32 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.01 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.23 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.4 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.53 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 61.3 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.44 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.35 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p -168.12 140.91 3.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 63.04 110.5 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.4 m -156.24 -19.07 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.37 -0.377 . . . . 51.11 111.133 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.84 -0.6 . . . . 54.44 110.043 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.861 0.362 . . . . 73.03 110.917 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt -75.96 167.39 21.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.159 -0.473 . . . . 74.43 109.921 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.31 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.33 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.24 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.23 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.34 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.34 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -83.94 139.8 8.68 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.34 112.694 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.83 155.1 37.92 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.792 -0.64 . . . . 70.41 109.466 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -147.7 97.77 2.87 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.253 0.549 . . . . 74.22 109.763 -178.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 40.4 m -85.89 130.4 50.66 Favored Pre-proline 0 C--N 1.313 -0.98 0 CA-C-N 115.34 -0.845 . . . . 71.0 109.332 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -56.65 121.64 10.4 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.735 2.29 . . . . 74.41 112.009 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp -76.37 131.43 39.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.038 -0.528 . . . . 63.11 110.996 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 54.12 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.45 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 72.42 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.52 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.31 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.33 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.13 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 61.43 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 53.44 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p -156.21 90.45 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.33 109.877 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -159.9 94.9 1.15 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.643 -0.708 . . . . 71.4 109.957 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.9 m -94.67 142.43 13.49 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 115.986 -0.552 . . . . 62.0 111.139 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.17 121.8 24.82 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.865 -0.607 . . . . 55.41 109.895 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 p -151.79 101.51 2.88 Favored Pre-proline 0 C--N 1.313 -1.014 0 CA-C-O 121.051 0.453 . . . . 30.3 111.049 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -85.44 154.13 10.59 Favored 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.801 2.334 . . . . 74.34 111.705 178.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.49 140.81 30.52 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.371 2.048 . . . . 74.3 111.586 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.21 126.15 89.36 Favored Pre-proline 0 C--N 1.316 -0.854 0 CA-C-N 116.08 -0.509 . . . . 73.15 110.211 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.03 122.23 10.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.709 2.273 . . . . 44.3 111.091 178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.1 t 62.31 80.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.816 -0.629 . . . . 73.31 109.91 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 t -83.15 -19.94 35.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.986 -0.552 . . . . 72.12 110.404 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -125.46 111.02 14.61 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.539 -0.541 . . . . 75.34 109.539 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.23 102.34 0.83 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.669 -0.777 . . . . 53.1 111.791 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.1 13.73 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.857 0.361 . . . . 71.11 110.495 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -164.26 163.37 22.71 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.82 -0.807 . . . . 42.11 108.82 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -154.79 134.34 7.77 Favored Pre-proline 0 C--N 1.311 -1.101 0 C-N-CA 120.774 -0.37 . . . . 74.3 110.982 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -64.05 108.32 0.93 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.208 1.939 . . . . 60.24 110.411 177.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.3 m -81.28 78.81 8.03 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.562 0.696 . . . . 74.43 110.696 -177.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.3 tt -86.18 107.45 17.89 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.066 -0.97 . . . . 73.52 109.109 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 m -71.23 104.31 3.07 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 110.056 -0.35 . . . . 74.24 110.056 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.4 m -75.49 85.19 2.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.06 0.457 . . . . 53.11 111.128 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.37 139.84 4.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.561 -0.745 . . . . 74.04 109.924 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.6 m -147.0 26.56 1.09 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.932 0.872 . . . . 74.42 109.072 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.91 -160.61 0.64 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.837 -1.074 . . . . 74.44 108.594 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -75.58 148.4 82.77 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 120.601 -0.44 . . . . 65.03 110.5 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.34 138.1 55.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.161 2.574 . . . . 65.34 112.614 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.52 144.77 96.68 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.827 -0.624 . . . . 44.25 110.483 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.74 123.26 13.42 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.982 2.455 . . . . 74.15 112.4 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.8 m -83.58 28.01 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-N 115.817 -0.629 . . . . 63.24 111.65 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -163.13 152.6 15.18 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.022 -0.535 . . . . 51.31 109.652 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.7 m 63.64 32.59 13.8 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.66 0.6 . . . . 75.41 110.416 -178.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.8 141.1 92.13 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.37 -0.832 . . . . 63.32 110.476 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.42 174.71 10.46 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.471 2.114 . . . . 63.5 112.144 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m -83.91 -175.66 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 116.153 -0.476 . . . . 74.02 110.572 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.23 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.22 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 62.51 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.21 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.43 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.05 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.21 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.13 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.14 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 73.0 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.23 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.12 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.02 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 71.41 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.54 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.13 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.552 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.1 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.44 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.44 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.13 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.51 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 52.11 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.24 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.22 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.23 110.69 178.089 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 52.11 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.21 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.11 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.31 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.435 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.24 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.552 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 53.2 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.12 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.35 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.43 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.24 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.34 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.33 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.12 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.419 ' HB ' HD12 ' A' ' 93' ' ' LEU . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.45 109.468 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.34 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 63.21 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.44 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.21 110.616 -176.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.22 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.54 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.4 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.52 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.43 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.22 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.34 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.01 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.31 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.477 ' HE1' ' HB3' ' A' ' 114' ' ' LEU . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.43 109.885 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.435 HG13 ' HA ' ' A' ' 153' ' ' GLU . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.15 110.322 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 61.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 53.33 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.34 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 63.31 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.31 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 64.53 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.45 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.44 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.02 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.487 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.35 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.05 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.528 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.41 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.42 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.7 ' O ' HG22 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.14 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.33 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.01 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.7 HG22 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.42 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 74.02 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.4 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 64.52 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.14 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 54.41 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.12 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.31 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.43 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.474 HD22 HD23 ' A' ' 114' ' ' LEU . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.22 111.117 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.41 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.14 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.24 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.23 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 72.34 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.24 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.42 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HA ' HG13 ' A' ' 117' ' ' VAL . 15.1 pt-20 -171.06 -42.39 0.02 OUTLIER 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.13 110.94 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.8 p -137.11 123.53 20.76 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.066 -0.516 . . . . 65.33 110.067 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -78.68 124.16 27.89 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 64.04 110.131 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -156.17 165.1 37.38 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.889 -0.596 . . . . 73.14 109.911 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.54 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.34 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.53 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.55 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 52.21 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 71.42 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 64.34 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.35 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.4 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.43 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p -169.67 171.74 7.28 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.54 110.299 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.6 m -159.49 136.6 9.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.16 -0.311 . . . . 72.12 110.16 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 169' ' ' ARG . 52.4 mtt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.766 -0.635 . . . . 73.03 110.38 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 74.9 t60 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.686 -0.487 . . . . 65.21 109.686 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 71.01 130.19 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.398 0.679 . . . . 32.11 111.716 -177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 13.22 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.34 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.42 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.13 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.15 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.12 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.3 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.41 153.9 75.43 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.2 112.208 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.0 118.61 1.77 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.88 -0.6 . . . . 35.4 110.289 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.41 175.89 13.41 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.086 -0.507 . . . . 75.23 110.735 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 p -85.01 147.94 49.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.251 -0.432 . . . . 61.05 111.553 -178.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.04 150.18 82.57 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.65 2.233 . . . . 74.34 111.35 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp -76.11 94.54 3.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.06 0.457 . . . . 72.14 111.248 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.45 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.21 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.24 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.41 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.11 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.03 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.21 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.51 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.15 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -85.77 129.15 38.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 52.44 111.364 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -160.47 -44.57 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.09 -0.959 . . . . 74.01 108.585 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.35 91.12 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 CA-C-N 115.173 -0.921 . . . . 64.31 109.243 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -76.41 -53.94 7.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.653 -0.703 . . . . 73.24 111.14 -176.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.0 m -83.25 133.79 47.01 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 115.989 -0.55 . . . . 72.12 110.499 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 33' ' ' PRO . 18.2 Cg_endo -60.75 120.82 8.76 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.626 2.218 . . . . 61.24 111.977 178.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 32' ' ' PRO . 24.5 Cg_exo -64.67 176.81 2.6 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 123.087 2.525 . . . . 64.42 112.181 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.47 154.1 84.97 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.961 -0.563 . . . . 60.01 110.256 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.99 -22.69 47.92 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 123.168 2.579 . . . . 74.41 113.309 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.77 -22.94 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.133 0.492 . . . . 62.13 110.524 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.3 m -91.48 143.0 27.05 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.607 -0.724 . . . . 72.05 109.324 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -88.12 134.63 33.72 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.281 -0.266 . . . . 72.14 110.281 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.96 -34.76 90.76 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.228 -0.51 . . . . 75.14 112.153 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.61 92.49 1.16 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.981 0.42 . . . . 55.32 110.857 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.82 95.19 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.888 -0.597 . . . . 53.11 110.068 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 60.8 mtt -144.9 92.14 5.86 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 109.313 -0.625 . . . . 71.41 109.313 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -85.36 103.64 0.8 Allowed 'Trans proline' 0 N--CA 1.448 -1.198 0 C-N-CA 122.683 2.255 . . . . 73.03 113.444 -177.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -85.06 99.53 11.09 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.03 -0.73 . . . . 64.1 109.03 175.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.15 121.32 3.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.934 -0.765 . . . . 60.4 108.934 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 m -158.24 13.92 0.2 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.788 0.328 . . . . 62.53 110.222 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.1 m 64.35 179.08 0.17 Allowed 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.738 -0.665 . . . . 72.11 111.719 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.08 -52.45 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.937 -0.574 . . . . 64.14 109.779 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.6 m 60.02 89.65 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.412 -0.813 . . . . 72.34 111.283 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.71 101.95 0.91 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-N 116.108 -0.497 . . . . 41.44 110.648 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.2 pm0 -81.17 144.8 54.96 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 115.51 -0.768 . . . . 74.41 110.36 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.84 116.48 4.31 Favored 'Trans proline' 0 C--O 1.239 0.529 0 C-N-CA 122.411 2.074 . . . . 75.33 111.782 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -77.64 127.74 81.6 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 63.12 111.191 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -80.06 116.21 3.36 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.71 2.273 . . . . 54.12 112.108 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.0 t -81.74 104.57 10.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.298 -0.41 . . . . 64.21 110.174 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.33 75.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 51.03 110.793 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.2 m -159.18 157.89 31.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.889 -0.596 . . . . 75.54 109.748 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 119.76 71.76 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 110.245 -0.28 . . . . 73.21 110.245 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -88.2 169.72 6.1 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.595 2.197 . . . . 74.41 112.519 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -89.63 151.69 3.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.251 -0.648 . . . . 74.45 109.251 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.11 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.33 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.02 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.423 ' HB2' ' HB2' ' A' ' 67' ' ' SER . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.44 111.732 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.53 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.14 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' PRO . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.23 111.262 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.34 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.21 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.3 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.14 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.2 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.21 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.55 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.579 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.32 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.31 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.13 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.42 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.44 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.32 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 65.24 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.34 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.4 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.32 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.44 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.01 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.43 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.23 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.41 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.529 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.52 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.32 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.526 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.02 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.2 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.35 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.51 107.949 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.644 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.24 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.33 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 71.22 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.31 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.569 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.3 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.53 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.02 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.31 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.21 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.23 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.15 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.44 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.12 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.22 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.651 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.3 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.13 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 52.45 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.4 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.44 109.703 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 118' ' ' SER . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.21 112.471 177.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 73.33 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.12 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.32 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 62.4 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.43 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 44.32 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.32 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.15 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 41.54 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.33 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.54 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.24 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.578 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.03 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.33 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.2 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.03 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.54 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.04 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.51 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.12 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.11 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 64.0 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.24 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.447 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.04 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.02 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.05 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.11 109.648 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.03 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 61.22 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.01 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.22 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -159.05 -37.48 0.06 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 61.02 110.163 178.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.6 m -135.63 -73.64 0.45 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.28 -0.418 . . . . 63.23 111.308 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.71 160.87 38.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.625 0.25 . . . . 63.32 110.658 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.67 102.76 11.71 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.355 -0.384 . . . . 62.33 110.495 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.03 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.45 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.43 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.24 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.55 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.32 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.21 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' GLN . . . . . 0.46 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.8 t -168.59 175.62 6.09 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 63.52 109.083 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 53.2 m -158.38 153.5 25.46 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.687 0.279 . . . . 71.53 110.254 -179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.438 -0.791 . . . . 64.35 109.747 177.92 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.4 m80 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.959 0.409 . . . . 74.44 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -117.17 -173.2 2.36 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.943 -0.571 . . . . 74.41 110.47 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.15 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 60.43 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.33 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.22 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.03 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.02 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.21 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.45 136.24 33.29 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.23 111.549 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 131.8 45.04 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.933 -0.576 . . . . 71.34 109.963 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.5 mt -141.95 133.24 26.41 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.163 -0.472 . . . . 73.32 109.941 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.9 p -82.66 122.15 78.32 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 116.071 -0.513 . . . . 53.31 110.39 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -57.3 128.69 30.59 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.489 2.126 . . . . 72.44 111.339 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.09 105.18 5.98 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.1 0.476 . . . . 62.53 110.087 -178.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.4 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.42 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.24 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.53 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.12 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.14 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.33 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.52 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.51 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -99.87 121.9 51.11 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.02 112.043 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -86.09 109.4 18.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.808 -0.633 . . . . 70.05 110.078 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.5 p -83.17 114.19 23.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-O 121.239 0.542 . . . . 71.0 110.27 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -158.74 107.99 1.96 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.908 -0.587 . . . . 53.12 110.305 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.4 p -154.28 85.86 3.76 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 115.941 -0.572 . . . . 72.33 110.607 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -78.99 125.0 6.33 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.477 2.118 . . . . 72.03 112.092 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -54.63 132.4 51.21 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.878 2.385 . . . . 65.33 112.021 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.33 136.38 81.48 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.011 -0.54 . . . . 75.45 111.087 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -83.56 -155.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.702 2.268 . . . . 71.52 111.317 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -79.8 -41.61 21.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 120.94 -0.304 . . . . 44.23 110.941 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 21.8 m 50.82 81.89 0.06 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.457 0.703 . . . . 64.15 111.955 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -120.98 136.18 55.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.89 0.376 . . . . 75.13 111.002 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -162.99 110.36 0.42 Allowed Glycine 0 N--CA 1.437 -1.294 0 N-CA-C 111.435 -0.666 . . . . 44.11 111.435 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 42' ' ' MET . . . -165.77 -44.31 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 110.532 -0.173 . . . . 71.23 110.532 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 72.65 -35.46 0.33 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 61.02 111.993 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.406 ' H ' ' C ' ' A' ' 40' ' ' ALA . 24.8 ptt? -155.77 155.91 30.02 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.041 -0.726 . . . . 73.31 109.041 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.75 177.28 3.57 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 122.248 1.965 . . . . 71.44 111.618 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.9 p -81.09 145.07 31.27 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.668 -0.242 . . . . 75.51 110.824 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -159.9 178.13 10.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.567 -0.531 . . . . 71.25 109.567 -178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -76.68 -98.56 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.416 0.151 . . . . 64.03 110.891 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.4 m 59.83 172.92 0.08 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.682 0.623 . . . . 74.14 112.682 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 65.62 2.44 2.07 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.258 -0.883 . . . . 52.04 113.109 176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -91.04 -52.77 4.68 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.608 0.242 . . . . 74.43 111.199 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.69 -169.54 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.612 -0.722 . . . . 72.02 111.454 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -82.85 129.17 62.92 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 116.357 -0.383 . . . . 73.33 110.19 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.69 166.55 29.49 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.732 2.288 . . . . 71.44 111.985 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.3 mp -89.15 114.87 61.95 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 72.33 110.043 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -79.79 174.46 11.64 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.731 2.287 . . . . 65.12 112.625 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t 73.68 143.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 115.571 -0.741 . . . . 64.34 111.281 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.84 163.9 18.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.947 -0.57 . . . . 64.53 110.666 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t 65.85 81.11 0.21 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.439 0.638 . . . . 61.05 109.506 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.4 147.7 95.15 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 115.365 -0.834 . . . . 64.01 110.687 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -63.89 177.72 1.74 Allowed 'Trans proline' 0 C--O 1.236 0.414 0 C-N-CA 122.554 2.169 . . . . 55.13 111.625 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.98 176.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 116.329 -0.396 . . . . 54.24 110.844 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.41 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.45 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.14 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.02 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 62.24 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.12 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 62.3 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.55 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.42 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.13 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.11 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.41 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.32 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.44 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.63 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.23 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.33 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.31 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.31 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.33 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.22 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.33 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 74.33 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.51 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.32 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.35 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.42 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.13 111.475 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.41 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.33 109.705 -177.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.21 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.34 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.453 HD13 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 62.22 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.13 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 101' ' ' VAL . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.23 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.672 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.33 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.672 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.13 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.13 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 44.13 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.1 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.592 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.55 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.3 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 93' ' ' LEU . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.21 108.883 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.23 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.409 HG22 ' N ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.14 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 64.24 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.22 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.11 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.52 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.24 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.52 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.3 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.13 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.12 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 76.6 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 54.21 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.53 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 61.23 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.13 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.44 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 73.3 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.2 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.2 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.32 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.524 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.13 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.4 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.01 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 73.1 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 64.25 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.53 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.22 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.42 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.48 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.34 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.34 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 63.44 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.32 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.13 110.049 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.13 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.14 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.44 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.31 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.52 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.53 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.24 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.13 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.23 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 54.24 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.34 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.22 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.41 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.53 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.42 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.41 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -135.73 -61.51 0.72 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.24 110.41 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.1 t -145.26 -170.95 3.56 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.64 -0.504 . . . . 64.5 109.64 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -77.41 126.9 31.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.788 0.328 . . . . 74.44 110.503 -178.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.77 171.43 20.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.885 -0.598 . . . . 74.53 110.227 -178.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.12 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.23 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.23 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.41 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 45.14 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.21 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.22 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.12 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 166' ' ' GLN . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.3 109.959 178.11 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t -73.78 95.22 2.36 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 13.3 m -79.07 162.27 25.98 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.723 -0.843 . . . . 74.34 108.723 176.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 118.168 -0.92 . . . . 72.15 109.587 178.443 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 34.5 m80 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.954 0.407 . . . . 72.43 111.003 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt -135.67 162.39 32.87 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.981 -0.748 . . . . 73.11 108.981 177.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 51.35 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.34 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.44 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.23 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.12 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.02 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.14 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.8 -172.91 1.46 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.14 111.846 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.3 162.28 25.08 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.152 -0.476 . . . . 73.21 110.49 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 96.6 mt -144.69 141.72 29.52 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.945 -0.761 . . . . 75.32 108.945 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -85.81 120.48 72.8 Favored Pre-proline 0 C--N 1.309 -1.174 0 CA-C-N 116.412 -0.358 . . . . 75.11 111.405 -178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -62.1 134.43 49.24 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.215 1.944 . . . . 63.31 109.822 175.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt -148.38 116.88 6.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.057 0.456 . . . . 71.1 110.989 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.43 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 42.04 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.54 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.55 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.45 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.24 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.32 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.14 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.44 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.21 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m -141.98 -175.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.44 110.401 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -145.99 145.92 30.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.827 0.346 . . . . 73.51 110.761 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.7 m -88.19 -169.98 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.952 -0.567 . . . . 63.33 110.149 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 23.8 t70 -152.71 137.65 17.18 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.734 0.302 . . . . 63.34 110.804 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.2 m -85.79 110.6 31.41 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 116.01 -0.541 . . . . 64.33 110.395 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 30' ' ' ASP . 22.8 Cg_exo -65.39 127.37 18.04 Favored 'Trans proline' 0 C--O 1.238 0.49 0 C-N-CA 122.597 2.198 . . . . 62.23 111.788 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -65.03 134.13 38.5 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.657 2.238 . . . . 62.44 112.195 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.37 139.87 92.34 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.529 -0.545 . . . . 55.14 109.529 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.22 49.43 1.05 Allowed 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.884 2.39 . . . . 74.33 113.442 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.9 t -87.05 99.05 7.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.953 0.406 . . . . 75.31 110.041 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.0 p -91.51 -13.69 31.71 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.07 -0.514 . . . . 73.14 111.278 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -80.85 145.68 31.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.193 -0.458 . . . . 73.11 110.391 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 110.73 138.82 7.91 Favored Glycine 0 N--CA 1.438 -1.212 0 C-N-CA 120.741 -0.743 . . . . 64.42 111.717 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.15 100.35 0.85 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.034 0.445 . . . . 71.35 110.391 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -167.14 88.08 0.3 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.512 -0.767 . . . . 64.42 109.575 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -86.6 120.38 71.91 Favored Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 115.598 -0.728 . . . . 44.03 110.66 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.96 142.27 61.54 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.295 1.996 . . . . 74.35 110.95 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -151.25 157.24 42.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 116.691 -0.231 . . . . 72.33 110.662 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 tp 60.37 63.45 1.38 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.959 0.787 . . . . 74.41 111.505 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 p -170.39 135.66 1.26 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.781 -0.645 . . . . 74.24 110.196 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.5 m -135.52 -51.97 0.75 Allowed 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.375 -0.232 . . . . 74.51 110.375 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 61.51 -177.45 0.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.809 -0.632 . . . . 62.11 112.597 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.1 m -148.09 125.3 11.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.532 -0.758 . . . . 71.34 109.113 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.91 152.95 11.77 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.308 -0.256 . . . . 50.25 110.308 -178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -82.23 151.39 66.15 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.284 -0.416 . . . . 74.4 110.13 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.507 ' HA ' ' OE1' ' A' ' 137' ' ' GLN . 60.9 Cg_exo -53.45 123.37 13.14 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.902 2.401 . . . . 72.12 111.963 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 90.2 mt -69.36 124.17 89.91 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 116.09 -0.505 . . . . 41.51 111.072 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 16.0 Cg_exo -67.84 111.73 2.48 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.286 1.991 . . . . 74.32 110.573 177.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 m -77.61 152.63 5.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.119 0.485 . . . . 75.34 111.753 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.4 -174.66 2.3 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.331 -0.85 . . . . 74.12 109.279 -178.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -71.96 122.17 20.38 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.403 -0.592 . . . . 61.25 109.403 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.92 114.82 22.62 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 55.42 112.393 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.81 -179.98 3.13 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.426 2.751 . . . . 34.21 110.919 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m -79.9 130.77 35.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.318 -0.623 . . . . 72.53 109.318 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 71.45 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.12 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.2 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.34 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.22 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.13 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 64.44 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.32 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.417 ' HE1' HD22 ' A' ' 93' ' ' LEU . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.54 109.81 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.25 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.12 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.23 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.13 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.33 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.1 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.31 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.606 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 73.34 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.44 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.44 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.35 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 60.1 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.33 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.04 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.13 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.51 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.44 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.14 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 49.4 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.22 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.54 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.12 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.417 HD22 ' HE1' ' A' ' 70' ' ' TRP . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.32 110.246 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 61.12 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.13 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.13 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.12 108.542 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.03 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.54 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.13 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.05 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.33 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.23 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.516 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 60.15 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.566 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.3 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.24 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.43 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.53 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.14 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.53 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.22 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.566 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.3 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.42 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.42 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.22 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.43 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.1 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 33.32 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 42.8 p-80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 61.31 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.31 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.04 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.24 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 51.32 110.371 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.12 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.23 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 54.13 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.22 110.267 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.33 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.41 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 65.13 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 51.11 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.35 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 70.0 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.432 ' HB3' HD12 ' A' ' 145' ' ' LEU . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.23 111.308 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.41 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' A' ' 52' ' ' PRO . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.12 111.291 -179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.41 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.34 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.32 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 62.02 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.24 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 61.22 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.436 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.43 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.432 HD12 ' HB3' ' A' ' 135' ' ' ARG . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.11 111.149 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.54 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.11 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.01 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 51.22 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.41 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.41 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.793 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.3 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 72.73 -48.06 0.68 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.51 110.091 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.0 p -162.03 -173.08 3.5 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 107.958 -1.127 . . . . 74.32 107.958 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -110.29 101.4 10.15 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.937 -0.705 . . . . 74.23 110.922 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -168.3 91.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.258 -0.883 . . . . 63.41 109.942 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.11 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.43 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.21 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 64.53 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.11 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.31 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.3 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.12 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.41 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.35 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m -163.52 91.36 0.67 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.23 110.295 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 10.4 p -81.76 84.86 6.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.027 0.442 . . . . 54.33 110.604 178.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.394 -0.812 . . . . 75.43 110.458 -179.882 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.1 mtm . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 120.69 0.281 . . . . 71.540000000000006 111.08 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.240000000000002 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.229999999999997 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 70.230000000000004 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.509999999999998 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.150000000000006 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.549999999999997 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.319999999999993 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.420000000000002 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo . . . . . 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.340000000000003 112.088 -179.531 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.846 0.355 . . . . 63.0 110.495 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.200000000000003 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.409999999999997 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.030000000000001 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.540000000000006 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 31.5 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.519999999999996 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.540000000000006 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.239999999999995 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.219999999999999 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.109999999999999 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.240000000000002 111.207 -179.866 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 120.717 0.294 . . . . 73.239999999999995 110.962 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.607 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.530000000000001 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 64.340000000000003 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.530000000000001 108.823 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.399999999999999 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 52.310000000000002 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.109999999999999 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.319999999999993 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.040000000000006 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 42.539999999999999 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.607 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.010000000000005 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.319999999999993 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.030000000000001 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.425 ' HA ' HD13 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.420000000000002 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.010000000000005 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.549999999999997 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.219999999999999 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.030000000000001 111.273 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.340000000000003 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 64.099999999999994 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.699 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.439999999999998 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.150000000000006 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.409999999999997 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.540000000000006 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.688 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.310000000000002 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.420000000000002 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.549999999999997 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.109999999999999 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.340000000000003 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.461 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.209999999999994 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.530000000000001 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 73.239999999999995 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.439999999999998 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.149999999999999 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.219999999999999 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 61.219999999999999 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.461 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.140000000000001 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.510000000000005 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 65.420000000000002 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.420000000000002 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.310000000000002 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.409999999999997 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 72.109999999999999 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.010000000000005 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.130000000000003 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.400000000000006 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.299999999999997 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.310000000000002 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.439999999999998 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.340000000000003 112.199 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.310000000000002 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.420000000000002 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.210000000000001 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.109999999999999 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 61.149999999999999 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.688 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.099999999999994 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.349999999999994 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 45.210000000000001 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 55.229999999999997 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 72.349999999999994 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.109999999999999 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.129999999999995 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.200000000000003 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.140000000000001 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.522 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.150000000000006 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.549999999999997 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.219999999999999 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.329999999999998 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.530000000000001 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.418 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.210000000000001 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.540000000000006 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.329999999999998 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.010000000000005 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.349999999999994 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.549999999999997 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.340000000000003 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.409999999999997 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.219999999999999 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.409999999999997 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.52 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.230000000000004 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.009999999999998 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.439999999999998 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.140000000000001 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.439999999999998 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.688 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.119999999999997 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.539999999999999 109.198 178.513 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.748 -0.464 . . . . 55.140000000000001 109.748 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.540000000000006 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.230000000000004 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.209999999999994 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 33.119999999999997 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.219999999999999 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.319999999999993 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.209999999999994 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . 0.581 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.310000000000002 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.140000000000001 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.230000000000004 110.635 -177.246 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.705 -0.479 . . . . 64.209999999999994 109.705 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.450000000000003 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.240000000000002 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.409999999999997 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.140000000000001 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 74.319999999999993 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.400000000000006 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo . . . . . 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.210000000000001 111.829 179.294 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.412 ' O ' HD12 ' A' ' 16' ' ' LEU . 2.2 pp . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.818 0.342 . . . . 72.420000000000002 110.936 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.530000000000001 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.420000000000002 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.040000000000006 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.140000000000001 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.140000000000001 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.149999999999999 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.409999999999997 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.319999999999993 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 55.299999999999997 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.030000000000001 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p . . . . . 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.430000000000007 109.938 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.235 0.337 0 CA-C-O 121.076 0.465 . . . . 75.109999999999999 111.166 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 93' ' ' LEU . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.450000000000003 110.527 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.340000000000003 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.319999999999993 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.430000000000007 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.57 HD23 ' H ' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.019999999999996 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.150000000000006 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.420000000000002 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.299999999999997 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.439999999999998 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.099999999999994 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 62.219999999999999 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.310000000000002 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.150000000000006 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.340000000000003 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 64.530000000000001 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.319999999999993 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.129999999999995 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.487 HG11 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.310000000000002 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.467 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.450000000000003 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.430000000000007 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.531 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.140000000000001 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.340000000000003 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.420000000000002 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.030000000000001 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.510000000000005 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.41 HE21 ' HD1' ' A' ' 81' ' ' PHE . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.239999999999995 110.336 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.547 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.530000000000001 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.020000000000003 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 72.329999999999998 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.229999999999997 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 103' ' ' ILE . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.219999999999999 109.464 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.129999999999995 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.049999999999997 112.437 -172.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.553 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 74.219999999999999 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 70.239999999999995 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.519999999999996 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.150000000000006 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.420000000000002 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.340000000000003 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.430000000000007 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 91' ' ' LEU . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.210000000000001 108.575 177.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.430000000000007 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.422 HD11 HD22 ' A' ' 91' ' ' LEU . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.530000000000001 110.633 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.565 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.519999999999996 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.340000000000003 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.420000000000002 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.299999999999997 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.540000000000006 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.439999999999998 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.109999999999999 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.209999999999994 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.519 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.430000000000007 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.439999999999998 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.120000000000005 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.565 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 12.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.420000000000002 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 72.400000000000006 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.340000000000003 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.219999999999999 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.120000000000005 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.129999999999995 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.120000000000005 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.130000000000003 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.310000000000002 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.340000000000003 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.430000000000007 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.430000000000007 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.099999999999994 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.230000000000004 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.409999999999997 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.240000000000002 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.457 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.439999999999998 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.510000000000005 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.230000000000004 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.120000000000005 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.439999999999998 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.409999999999997 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.349999999999994 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.209999999999994 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.299999999999997 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.540000000000006 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.230000000000004 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.099999999999994 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.349999999999994 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.510000000000005 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.019999999999996 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.350000000000001 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.450000000000003 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.530000000000001 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.030000000000001 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.230000000000004 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 61.43 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.340000000000003 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.340000000000003 111.463 179.287 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 120.863 0.363 . . . . 73.5 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.539999999999999 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.140000000000001 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.010000000000005 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.149999999999999 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.310000000000002 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.039999999999999 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.009999999999998 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.439999999999998 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.430000000000007 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.439999999999998 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.150000000000006 110.093 -179.077 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 121.106 0.479 . . . . 55.229999999999997 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 60.329999999999998 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.420000000000002 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.209999999999994 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.100000000000001 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.67 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.530000000000001 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.67 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.219999999999999 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.209999999999994 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.409999999999997 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.450000000000003 113.118 -177.056 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.582 0.23 . . . . 53.240000000000002 110.526 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.510000000000005 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.299999999999997 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.200000000000003 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.039999999999999 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.019999999999996 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.329999999999998 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.219999999999999 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 53.420000000000002 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.229999999999997 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.039999999999999 110.74 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.530000000000001 110.728 178.593 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.150000000000006 109.811 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.438 HD23 HD11 ' A' ' 93' ' ' LEU . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.430000000000007 110.705 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 62.439999999999998 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.310000000000002 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.299999999999997 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 65' ' ' LEU . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 52.039999999999999 110.288 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.310000000000002 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.450000000000003 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.140000000000001 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.209999999999994 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.450000000000003 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.594 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.010000000000005 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.540000000000006 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.010000000000005 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.439999999999998 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 64.409999999999997 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.030000000000001 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.552 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 64.420000000000002 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.540000000000006 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.530000000000001 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.430000000000007 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.552 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 44.3 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.120000000000005 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.130000000000003 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.4 HE21 ' HB2' ' A' ' 86' ' ' GLN . 3.1 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.240000000000002 111.197 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.439999999999998 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.109999999999999 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 51.549999999999997 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.430000000000007 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.439999999999998 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.519999999999996 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.438 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.683 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.040000000000006 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.683 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.010000000000005 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.420000000000002 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.120000000000005 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.549999999999997 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.539999999999999 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.409999999999997 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.450000000000003 107.809 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.533 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.530000000000001 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.299999999999997 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.743 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 52.030000000000001 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.530000000000001 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.319999999999993 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.349999999999994 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.109999999999999 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.219999999999999 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.531 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 54.299999999999997 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.209999999999994 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 63.140000000000001 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.030000000000001 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 65.019999999999996 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.120000000000005 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.533 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 61.409999999999997 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.209999999999994 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.439999999999998 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 63.130000000000003 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 52.299999999999997 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.239999999999995 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 51.520000000000003 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.239999999999995 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.150000000000006 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.109999999999999 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.129999999999995 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.329999999999998 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.010000000000005 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.109999999999999 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.432 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.530000000000001 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.409999999999997 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 43.020000000000003 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.239999999999995 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 70.540000000000006 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.439999999999998 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.239999999999995 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.450000000000003 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.530000000000001 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.399999999999999 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.230000000000004 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.120000000000005 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.230000000000004 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.504 HD23 ' HB3' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.519999999999996 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.149999999999999 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 61.32 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.420000000000002 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.150000000000006 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 60.119999999999997 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.140000000000001 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.109999999999999 110.777 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 120.852 0.358 . . . . 63.240000000000002 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.450000000000003 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.229999999999997 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 62.340000000000003 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . 0.453 ' HA ' ' OE1' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.219999999999999 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.009999999999998 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.340000000000003 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.230000000000004 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.510000000000005 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.420000000000002 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.209999999999994 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.409999999999997 109.148 179.43 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.444 -0.746 0 N-CA-C 108.863 -0.791 . . . . 74.140000000000001 108.863 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.420000000000002 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.520000000000003 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.450000000000003 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.409999999999997 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.439999999999998 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.299999999999997 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.319999999999993 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.329999999999998 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.230000000000004 111.665 179.811 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 N--CA 1.447 -0.608 0 CA-C-O 120.752 0.31 . . . . 53.310000000000002 110.503 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.140000000000001 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.129999999999995 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.310000000000002 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.420000000000002 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.030000000000001 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.219999999999999 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.209999999999994 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.430000000000007 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.099999999999994 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.140000000000001 110.37 178.181 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.747 0.308 . . . . 65.140000000000001 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 72.409999999999997 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.310000000000002 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 52.350000000000001 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.140000000000001 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.200000000000003 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.219999999999999 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 41.350000000000001 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.430000000000007 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.129999999999995 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.209999999999994 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.409999999999997 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.436 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.030000000000001 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 40.420000000000002 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 45.3 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.350000000000001 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.149999999999999 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.039999999999999 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.149999999999999 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 61.219999999999999 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 54.200000000000003 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.040000000000006 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.540000000000006 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.450000000000003 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.430000000000007 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.219999999999999 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.439999999999998 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.439999999999998 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.530000000000001 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 52.229999999999997 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.430000000000007 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.549999999999997 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 101' ' ' VAL . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.219999999999999 111.461 -177.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.586 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.129999999999995 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.586 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.239999999999995 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.230000000000004 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.420000000000002 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.409999999999997 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.399999999999999 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.319999999999993 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.420000000000002 109.274 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.240000000000002 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.099999999999994 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 62.130000000000003 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 62.409999999999997 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.439999999999998 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.319999999999993 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.340000000000003 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.109999999999999 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.209999999999994 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.445 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.010000000000005 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.340000000000003 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.525 HE21 ' NE2' ' A' ' 147' ' ' GLN . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 63.450000000000003 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.039999999999999 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.532 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.099999999999994 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.436 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.439999999999998 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.319999999999993 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.450000000000003 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.040000000000006 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.530000000000001 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.239999999999995 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.209999999999994 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.209999999999994 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.219999999999999 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.440000000000001 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.310000000000002 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.310000000000002 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.439999999999998 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.340000000000003 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 52.450000000000003 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.505 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.349999999999994 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.400000000000006 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.439999999999998 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.530000000000001 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.400000000000006 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.464 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.430000000000007 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 63.32 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.340000000000003 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.329999999999998 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 72.209999999999994 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.409999999999997 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.439999999999998 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.310000000000002 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.209999999999994 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.525 ' NE2' HE21 ' A' ' 113' ' ' GLN . 28.1 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.519999999999996 110.837 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 42.310000000000002 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 73.430000000000007 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.319999999999993 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.140000000000001 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 51.420000000000002 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.986 0.422 . . . . 64.409999999999997 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.140000000000001 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.519999999999996 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 52.020000000000003 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.109999999999999 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 42.25 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.140000000000001 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.120000000000005 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 41.340000000000003 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.109999999999999 109.437 176.469 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.235 0.327 0 N-CA-C 109.594 -0.521 . . . . 72.329999999999998 109.594 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.420000000000002 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.340000000000003 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.420000000000002 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.540000000000006 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 52.009999999999998 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.229999999999997 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo . . . . . 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.329999999999998 112.074 179.532 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.391 0 CA-C-O 120.914 0.388 . . . . 63.350000000000001 110.943 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 64.329999999999998 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.340000000000003 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.519999999999996 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.200000000000003 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.519999999999996 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.129999999999995 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.549999999999997 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.510000000000005 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.219999999999999 109.318 175.7 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.087 -0.708 . . . . 62.450000000000003 109.087 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 72.409999999999997 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.340000000000003 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 61.210000000000001 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.350000000000001 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 123' ' ' VAL . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.540000000000006 110.633 -175.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.420000000000002 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 43.5 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.310000000000002 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.109999999999999 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.548 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 73.010000000000005 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.030000000000001 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.329999999999998 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.219999999999999 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.496 ' O ' HG23 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.120000000000005 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 34.32 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.099999999999994 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.349999999999994 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.200000000000003 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 52.240000000000002 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.010000000000005 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.409999999999997 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.030000000000001 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.239999999999995 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.539999999999999 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.030000000000001 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.340000000000003 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.593 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.420000000000002 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.319999999999993 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 2.3 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.510000000000005 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 61.210000000000001 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.239999999999995 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.541 HD12 HG21 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.030000000000001 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.504 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 70.129999999999995 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.504 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.409999999999997 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.450000000000003 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.310000000000002 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.409 HD22 ' HG2' ' A' ' 119' ' ' PRO . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.310000000000002 111.345 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.329999999999998 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.329999999999998 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.541 HG21 HD12 ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 73.540000000000006 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.439999999999998 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.549 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.109999999999999 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.623 HD11 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.030000000000001 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.420000000000002 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.009999999999998 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.539999999999999 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.450000000000003 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.516 ' HB3' HE21 ' A' ' 144' ' ' GLN . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.049999999999997 108.419 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.623 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 54.149999999999999 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.129999999999995 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 145' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 72.019999999999996 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.430000000000007 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.319999999999993 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.340000000000003 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.468 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.140000000000001 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.200000000000003 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.140000000000001 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.010000000000005 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.469 HG13 HD21 ' A' ' 65' ' ' LEU . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.299999999999997 109.176 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.319999999999993 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.319999999999993 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.409999999999997 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.409999999999997 109.693 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.409999999999997 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.340000000000003 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.239999999999995 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 65.409999999999997 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.239999999999995 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.329999999999998 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.409999999999997 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.120000000000005 110.542 178.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.140000000000001 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.450000000000003 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.4 HD12 HD22 ' A' ' 145' ' ' LEU . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.299999999999997 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 54.130000000000003 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.119999999999997 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.049999999999997 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.516 HE21 ' HB3' ' A' ' 111' ' ' GLN . 18.4 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.450000000000003 110.186 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 114' ' ' LEU . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.019999999999996 109.803 177.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.439999999999998 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.439999999999998 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.209999999999994 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.219999999999999 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.400000000000006 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.019999999999996 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.099999999999994 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 . . . . . 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 61.399999999999999 111.121 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.057 0.456 . . . . 52.200000000000003 110.355 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.119999999999997 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.530000000000001 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.049999999999997 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.439999999999998 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.230000000000004 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.219999999999999 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 30.550000000000001 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.430000000000007 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.219999999999999 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 64.409999999999997 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.120000000000005 110.451 -177.403 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 121.028 0.442 . . . . 72.340000000000003 112.191 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.109999999999999 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 43.310000000000002 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.239999999999995 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 51.399999999999999 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.200000000000003 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 54.219999999999999 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.409999999999997 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.430000000000007 111.672 -179.205 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.237 0.437 0 CA-C-O 120.727 0.299 . . . . 74.420000000000002 110.613 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 64.129999999999995 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.329999999999998 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.230000000000004 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.130000000000003 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.209999999999994 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.020000000000003 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.140000000000001 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 61.350000000000001 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 53.520000000000003 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.129999999999995 110.884 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.219999999999999 108.55 176.193 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.506 -0.553 . . . . 44.119999999999997 109.506 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.420000000000002 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.040000000000006 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.140000000000001 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.039999999999999 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.439999999999998 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 54.240000000000002 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.319999999999993 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 72.319999999999993 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.422 HE21 ' HB2' ' A' ' 130' ' ' ALA . 42.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.549999999999997 111.143 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.120000000000005 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 71.109999999999999 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 78' ' ' VAL . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 64.209999999999994 109.135 176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.129999999999995 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.140000000000001 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.519999999999996 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 74' ' ' PHE . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 64.340000000000003 110.879 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.477 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 55.229999999999997 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.519999999999996 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 86' ' ' GLN . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.140000000000001 111.484 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.450000000000003 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.409999999999997 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.200000000000003 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.439999999999998 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' PHE . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.040000000000006 109.713 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.299999999999997 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 63.130000000000003 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.150000000000006 112.842 -177.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.420000000000002 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.439999999999998 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.200000000000003 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.450000000000003 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.513 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.329999999999998 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.513 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 64.019999999999996 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.448 HD12 ' HG3' ' A' ' 97' ' ' GLU . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.030000000000001 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.209999999999994 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.409999999999997 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.409999999999997 110.222 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 71.540000000000006 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 64.099999999999994 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.439 HD11 ' HB1' ' A' ' 112' ' ' ALA . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.129999999999995 110.91 -177.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.439999999999998 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.464 HD11 HD13 ' A' ' 143' ' ' ILE . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.439999999999998 111.063 -172.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.530000000000001 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.120000000000005 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.409999999999997 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.209999999999994 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.510000000000005 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.554 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.299999999999997 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.430000000000007 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 65.409999999999997 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 65.540000000000006 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.019999999999996 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.230000000000004 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.425 ' OG ' HG22 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.409999999999997 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.239999999999995 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.425 HG22 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.230000000000004 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.526 ' HD3' HG21 ' A' ' 150' ' ' ILE . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.409999999999997 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.119999999999997 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 55.509999999999998 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.209999999999994 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.340000000000003 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.622 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.329999999999998 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.422 ' HB2' HE21 ' A' ' 71' ' ' GLN . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.400000000000006 112.587 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.109999999999999 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.622 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 63.43 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.420000000000002 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.539999999999999 111.745 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 71.129999999999995 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.019999999999996 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.219999999999999 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.420000000000002 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.439999999999998 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.409999999999997 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.464 HD13 HD11 ' A' ' 107' ' ' LEU . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.150000000000006 110.768 -179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.140000000000001 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 64.150000000000006 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.409999999999997 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.430000000000007 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.230000000000004 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.436 ' HB2' ' HA ' ' A' ' 115' ' ' GLN . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.340000000000003 109.529 176.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.526 HG21 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.430000000000007 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.109999999999999 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.82 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.509999999999998 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.209999999999994 106.384 179.37 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 109.573 -0.528 . . . . 74.230000000000004 109.573 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.329999999999998 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 62.420000000000002 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.520000000000003 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.420000000000002 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.129999999999995 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.329999999999998 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.420000000000002 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 64.439999999999998 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.040000000000006 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.120000000000005 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 40.340000000000003 109.983 -179.327 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 62.240000000000002 110.662 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.210000000000001 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 64.099999999999994 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.120000000000005 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.319999999999993 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.413 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.420000000000002 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.409999999999997 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 61.32 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.120000000000005 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.510000000000005 111.954 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.872 0.367 . . . . 63.329999999999998 111.091 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.099999999999994 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 74.519999999999996 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.150000000000006 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.549999999999997 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.319999999999993 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.530000000000001 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.130000000000003 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.439999999999998 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.420000000000002 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.120000000000005 109.891 177.199 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.425 HD23 HD11 ' A' ' 93' ' ' LEU . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.140000000000001 111.182 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.310000000000002 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.150000000000006 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.530000000000001 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.400000000000006 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.049999999999997 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.129999999999995 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.420000000000002 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.530000000000001 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 71.409999999999997 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.109999999999999 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.120000000000005 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 71.120000000000005 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.319999999999993 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.219999999999999 111.03 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.030000000000001 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.41 ' NE2' HD12 ' A' ' 91' ' ' LEU . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.409999999999997 112.491 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.405 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.129999999999995 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.515 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.209999999999994 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.120000000000005 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.319999999999993 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 70.120000000000005 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.549999999999997 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.420000000000002 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 63.420000000000002 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.240000000000002 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.340000000000003 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.239999999999995 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.41 HD12 ' NE2' ' A' ' 77' ' ' GLN . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.099999999999994 110.125 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.150000000000006 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 112.488 -175.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.647 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 39.0 m80 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.647 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.409999999999997 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.340000000000003 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.120000000000005 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.129999999999995 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.549999999999997 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.340000000000003 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.329999999999998 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.530000000000001 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.129999999999995 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.010000000000005 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.598 HD11 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.140000000000001 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.540000000000006 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.230000000000004 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.319999999999993 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.039999999999999 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.439999999999998 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.019999999999996 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.598 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.099999999999994 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.430000000000007 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.019999999999996 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.409999999999997 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.468 ' SD ' HD11 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.420000000000002 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.329999999999998 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.120000000000005 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.149999999999999 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.150000000000006 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.510000000000005 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 72.409999999999997 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.329999999999998 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 45.240000000000002 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 32.009999999999998 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.129999999999995 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.468 HD11 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.019999999999996 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.150000000000006 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.563 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.200000000000003 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 62.140000000000001 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.019999999999996 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.563 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.200000000000003 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.559 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.229999999999997 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.109999999999999 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.230000000000004 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.349999999999994 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.129999999999995 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.439999999999998 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.349999999999994 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.040000000000006 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.219999999999999 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.310000000000002 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.219999999999999 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.140000000000001 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.329999999999998 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.030000000000001 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 64.049999999999997 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 63.009999999999998 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.099999999999994 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.120000000000005 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.120000000000005 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.030000000000001 109.607 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 120.94 0.4 . . . . 51.399999999999999 110.706 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.510000000000005 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.030000000000001 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.209999999999994 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . 0.434 ' H ' ' CD ' ' A' ' 160' ' ' GLN . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.310000000000002 111.323 -178.199 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.150000000000006 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 43.32 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.329999999999998 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.519999999999996 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.200000000000003 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.239999999999995 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.519999999999996 110.476 -178.173 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 C--O 1.238 0.491 0 N-CA-C 109.975 -0.38 . . . . 74.310000000000002 109.975 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.049999999999997 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.340000000000003 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.230000000000004 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.209999999999994 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.319999999999993 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.519999999999996 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 70.319999999999993 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.149999999999999 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.120000000000005 111.505 179.57 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 121.015 0.436 . . . . 64.010000000000005 110.705 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 71.209999999999994 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.340000000000003 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.009999999999998 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.420000000000002 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.219999999999999 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.109999999999999 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.430000000000007 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.409999999999997 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.420000000000002 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.120000000000005 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p . . . . . 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.310000000000002 110.754 178.694 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.448 -0.574 0 CA-C-O 121.001 0.429 . . . . 73.409999999999997 110.317 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.549 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 53.340000000000003 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.239999999999995 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.509999999999998 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 64.120000000000005 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.540000000000006 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.230000000000004 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.200000000000003 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.420000000000002 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.430000000000007 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.549 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.049999999999997 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 53.140000000000001 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.200000000000003 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.239999999999995 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.230000000000004 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 55.539999999999999 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.239999999999995 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.519999999999996 111.161 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.140000000000001 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.340000000000003 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.420000000000002 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.299999999999997 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 42.240000000000002 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 72.519999999999996 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.109999999999999 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.230000000000004 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.409999999999997 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 61.409999999999997 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.340000000000003 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.511 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.329999999999998 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.519999999999996 111.901 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 62.329999999999998 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.140000000000001 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.453 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.040000000000006 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.453 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.409999999999997 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.010000000000005 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.119999999999997 110.372 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.329999999999998 110.933 176.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.520000000000003 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.129999999999995 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 53.420000000000002 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 73.510000000000005 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.239999999999995 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.030000000000001 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 74.519999999999996 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.340000000000003 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.140000000000001 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.239999999999995 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.519999999999996 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.510000000000005 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.519999999999996 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.522 ' HB3' HD23 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.409999999999997 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.120000000000005 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.049999999999997 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.120000000000005 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.403 ' HG3' HG13 ' A' ' 103' ' ' ILE . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.099999999999994 108.695 -176.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 60.140000000000001 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 44.439999999999998 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.519999999999996 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 61.43 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.409999999999997 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.510000000000005 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.030000000000001 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.409999999999997 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.539999999999999 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.350000000000001 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.119999999999997 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.049999999999997 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.120000000000005 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.519999999999996 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.349999999999994 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 61.509999999999998 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 71.430000000000007 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.439999999999998 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.418 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 14.1 mm100 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.329999999999998 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.230000000000004 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.230000000000004 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.420000000000002 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.329999999999998 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.519999999999996 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.120000000000005 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.522 HD23 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.230000000000004 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.009999999999998 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 17.4 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.439999999999998 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.030000000000001 110.384 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.020000000000003 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.340000000000003 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.129999999999995 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.219999999999999 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.140000000000001 110.955 179.445 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.816 0.341 . . . . 75.319999999999993 110.771 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.109999999999999 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.099999999999994 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.119999999999997 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.409999999999997 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 54.299999999999997 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.409999999999997 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.409999999999997 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.420000000000002 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.409999999999997 111.52 -178.722 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 110.193 -0.299 . . . . 73.230000000000004 110.193 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.450000000000003 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 63.100000000000001 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.329999999999998 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.439999999999998 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.219999999999999 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.310000000000002 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 65.340000000000003 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 11' ' ' PRO . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.399999999999999 112.537 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 10' ' ' GLY . 94.8 Cg_endo . . . . . 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.450000000000003 112.098 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-O 120.9 0.381 . . . . 71.519999999999996 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.150000000000006 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.120000000000005 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.439999999999998 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.099999999999994 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.210000000000001 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.510000000000005 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.109999999999999 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.540000000000006 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.510000000000005 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.530000000000001 110.434 -179.238 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.002 -0.74 . . . . 43.039999999999999 109.002 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 43.119999999999997 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.129999999999995 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HB1' ' HD2' ' A' ' 64' ' ' PRO . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.413 ' HD2' ' HB1' ' A' ' 63' ' ' ALA . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.530000000000001 110.76 176.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.430000000000007 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.230000000000004 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.409999999999997 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.329999999999998 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.040000000000006 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.010000000000005 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.439999999999998 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.099999999999994 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.684 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.200000000000003 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.140000000000001 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.400000000000006 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.120000000000005 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.130000000000003 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.130000000000003 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.430000000000007 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.439999999999998 111.757 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.230000000000004 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 72.439999999999998 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.409999999999997 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.209999999999994 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 74.310000000000002 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 41.549999999999997 111.214 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.420000000000002 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.129999999999995 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.510000000000005 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.019999999999996 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.400000000000006 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.230000000000004 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.040000000000006 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.340000000000003 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 45.200000000000003 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.239999999999995 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.549999999999997 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.200000000000003 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.501 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 54.100000000000001 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.430000000000007 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.530000000000001 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.671 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.140000000000001 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.109999999999999 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.420000000000002 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.230000000000004 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.120000000000005 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.58 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.129999999999995 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.671 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.530000000000001 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.100000000000001 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.426 ' CD2' HD22 ' A' ' 145' ' ' LEU . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.129999999999995 111.519 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.109999999999999 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.430000000000007 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.572 HG13 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.439999999999998 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.219999999999999 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.140000000000001 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.230000000000004 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.439999999999998 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.329999999999998 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.519999999999996 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.349999999999994 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 52.530000000000001 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.450000000000003 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.420000000000002 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.439999999999998 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.409999999999997 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.426 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.239999999999995 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.510000000000005 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.420000000000002 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.409999999999997 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 55.310000000000002 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.140000000000001 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.030000000000001 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.340000000000003 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 43.149999999999999 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.519999999999996 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.030000000000001 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.150000000000006 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.409999999999997 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.58 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 62.450000000000003 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 114' ' ' LEU . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.319999999999993 110.044 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.409999999999997 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.464 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.519999999999996 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.229999999999997 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.47 ' HG ' ' N ' ' A' ' 156' ' ' ALA . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 55.240000000000002 112.265 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.150000000000006 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.572 ' H ' HG13 ' A' ' 117' ' ' VAL . 37.2 mt-10 . . . . . 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.239999999999995 111.647 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.47 ' N ' ' HG ' ' A' ' 151' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.813 0.34 . . . . 63.350000000000001 110.768 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.049999999999997 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.430000000000007 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.240000000000002 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.349999999999994 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.129999999999995 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 44.219999999999999 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.349999999999994 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.409999999999997 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.129999999999995 109.654 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 51.310000000000002 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.82 0.343 . . . . 55.100000000000001 111.195 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 71.299999999999997 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.040000000000006 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 55.219999999999999 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.129999999999995 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.501 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.099999999999994 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.501 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.329999999999998 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.299999999999997 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.340000000000003 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo . . . . . 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.120000000000005 111.031 178.267 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.838 0.351 . . . . 64.219999999999999 110.312 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 65.239999999999995 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.530000000000001 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.040000000000006 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.399999999999999 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.230000000000004 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.219999999999999 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.409999999999997 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.430000000000007 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.409999999999997 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p . . . . . 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 63.43 108.187 176.384 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 120.673 0.273 . . . . 75.109999999999999 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 72.129999999999995 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 52.310000000000002 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 63.329999999999998 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.239999999999995 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.340000000000003 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.010000000000005 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 62.310000000000002 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.409999999999997 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.456 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.120000000000005 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.129999999999995 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.109999999999999 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 73.150000000000006 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.140000000000001 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.219999999999999 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.109999999999999 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.140000000000001 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.430000000000007 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.510000000000005 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.547 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.510000000000005 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.230000000000004 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.439999999999998 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.210000000000001 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.547 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 48.6 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.319999999999993 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.57 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 43.210000000000001 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.150000000000006 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.416 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.1 mp0 -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.049999999999997 109.038 175.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.219999999999999 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.519999999999996 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 64.140000000000001 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.200000000000003 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.230000000000004 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.329999999999998 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.420000000000002 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.530000000000001 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.210000000000001 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.430000000000007 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 72.310000000000002 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.129999999999995 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.219999999999999 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.299999999999997 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.150000000000006 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.239999999999995 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.120000000000005 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.558 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.120000000000005 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.409999999999997 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.558 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.420000000000002 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.149999999999999 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.400000000000006 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.239999999999995 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.409999999999997 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.530000000000001 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.559 HG13 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 74.540000000000006 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.340000000000003 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 70.349999999999994 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.230000000000004 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.430000000000007 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.450000000000003 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 63.539999999999999 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.409999999999997 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.129999999999995 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.319999999999993 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.520000000000003 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.510000000000005 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 42.520000000000003 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.568 ' O ' HG22 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.040000000000006 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 64.310000000000002 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.209999999999994 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.239999999999995 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 133' ' ' MET . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.109999999999999 110.06 178.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.401 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.439999999999998 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.299999999999997 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 70.219999999999999 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.229999999999997 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.401 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.319999999999993 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.239999999999995 110.124 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.340000000000003 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.150000000000006 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.329999999999998 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.030000000000001 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.209999999999994 109.185 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.329999999999998 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.559 ' H ' HG13 ' A' ' 117' ' ' VAL . 42.3 mt-10 . . . . . 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.230000000000004 109.519 -176.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 110.051 -0.352 . . . . 73.230000000000004 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.130000000000003 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.409999999999997 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.329999999999998 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 71.230000000000004 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.140000000000001 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 64.540000000000006 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.229999999999997 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.140000000000001 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.040000000000006 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.009999999999998 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 63.149999999999999 110.821 -179.232 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 110.118 -0.327 . . . . 65.099999999999994 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.130000000000003 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.439999999999998 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.613 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.310000000000002 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.120000000000005 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.613 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.099999999999994 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.409999999999997 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.039999999999999 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 34.450000000000003 111.852 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 120.758 0.313 . . . . 72.340000000000003 110.448 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.010000000000005 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.310000000000002 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.409999999999997 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.329999999999998 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.530000000000001 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.210000000000001 110.799 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.120000000000005 109.231 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.230000000000004 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 64.329999999999998 111.044 -179.771 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.991 -0.374 . . . . 64.099999999999994 109.991 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.340000000000003 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.439999999999998 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.219999999999999 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.209999999999994 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.64 HD23 ' H ' ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 65.420000000000002 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 55.32 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.120000000000005 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.420000000000002 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.329999999999998 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.530000000000001 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.349999999999994 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.668 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.040000000000006 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.530000000000001 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.109999999999999 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.099999999999994 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.120000000000005 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.540000000000006 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.541 HD13 ' HD3' ' A' ' 83' ' ' ARG . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.420000000000002 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.140000000000001 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.049999999999997 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' HD13 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.319999999999993 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.430000000000007 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.149999999999999 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.310000000000002 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 61.350000000000001 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.100000000000001 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.400000000000006 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.219999999999999 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.420000000000002 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.040000000000006 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.239999999999995 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.420000000000002 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.010000000000005 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.140000000000001 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.140000000000001 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.030000000000001 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.109999999999999 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 43.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.555 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 73.239999999999995 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.540000000000006 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 65.040000000000006 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 60.030000000000001 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.340000000000003 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.349999999999994 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.520000000000003 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 65.219999999999999 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.439999999999998 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.406 ' NE2' ' HD2' ' A' ' 106' ' ' LYS . 8.1 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.129999999999995 109.354 174.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.399999999999999 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.489 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.230000000000004 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 72.099999999999994 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.530000000000001 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.219999999999999 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.099999999999994 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.519999999999996 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.430000000000007 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.439999999999998 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.039999999999999 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.030000000000001 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 127' ' ' LEU . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.219999999999999 110.347 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.019999999999996 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 61.299999999999997 111.972 177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.030000000000001 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.099999999999994 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.229999999999997 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 63.210000000000001 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.109999999999999 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.400000000000006 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.209999999999994 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.040000000000006 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.109999999999999 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.040000000000006 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.519999999999996 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.140000000000001 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 61.420000000000002 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.240000000000002 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.340000000000003 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.210000000000001 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.409999999999997 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.120000000000005 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.519999999999996 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.430000000000007 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.430000000000007 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.140000000000001 108.293 176.068 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 110.206 -0.294 . . . . 73.530000000000001 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.540000000000006 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 33.310000000000002 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.319999999999993 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.010000000000005 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.400000000000006 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.530000000000001 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 61.299999999999997 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.439999999999998 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.350000000000001 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 63.039999999999999 110.5 -179.156 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 C--O 1.239 0.515 0 N-CA-C 109.921 -0.4 . . . . 74.430000000000007 109.921 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.310000000000002 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.329999999999998 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.239999999999995 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.230000000000004 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.340000000000003 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.340000000000003 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.340000000000003 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.340000000000003 112.694 -178.638 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.932 0.396 . . . . 63.109999999999999 110.996 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 54.119999999999997 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.450000000000003 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 72.420000000000002 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.519999999999996 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.329999999999998 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.299999999999997 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.129999999999995 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 61.43 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 53.439999999999998 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.329999999999998 109.877 178.671 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.697 0.284 . . . . 74.019999999999996 110.572 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.230000000000004 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.219999999999999 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 62.509999999999998 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.209999999999994 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.430000000000007 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.049999999999997 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.209999999999994 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.129999999999995 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.140000000000001 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 73.0 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.230000000000004 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.120000000000005 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.019999999999996 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 71.409999999999997 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.540000000000006 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.129999999999995 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.552 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.099999999999994 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.439999999999998 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.439999999999998 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.129999999999995 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.510000000000005 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 52.109999999999999 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.240000000000002 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.219999999999999 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.230000000000004 110.69 178.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 52.109999999999999 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.209999999999994 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.109999999999999 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.310000000000002 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.435 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.240000000000002 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.552 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 53.200000000000003 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.120000000000005 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.350000000000001 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.430000000000007 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.239999999999995 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.340000000000003 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.329999999999998 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.120000000000005 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.419 ' HB ' HD12 ' A' ' 93' ' ' LEU . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.450000000000003 109.468 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.340000000000003 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 63.210000000000001 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.439999999999998 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.210000000000001 110.616 -176.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.219999999999999 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.540000000000006 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.399999999999999 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.520000000000003 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.430000000000007 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.219999999999999 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.340000000000003 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.010000000000005 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.310000000000002 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.477 ' HE1' ' HB3' ' A' ' 114' ' ' LEU . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.430000000000007 109.885 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.435 HG13 ' HA ' ' A' ' 153' ' ' GLU . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.149999999999999 110.322 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 61.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 53.329999999999998 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.340000000000003 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 63.310000000000002 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.310000000000002 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 64.530000000000001 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.450000000000003 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.439999999999998 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.019999999999996 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.487 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.349999999999994 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.049999999999997 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.528 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.409999999999997 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.420000000000002 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.7 ' O ' HG22 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.140000000000001 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.329999999999998 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.010000000000005 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.7 HG22 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.420000000000002 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 74.019999999999996 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.400000000000006 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 64.519999999999996 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.140000000000001 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 54.409999999999997 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.119999999999997 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.310000000000002 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.430000000000007 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.474 HD22 HD23 ' A' ' 114' ' ' LEU . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.219999999999999 111.117 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.409999999999997 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.140000000000001 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.240000000000002 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.230000000000004 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 72.340000000000003 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.239999999999995 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.420000000000002 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HA ' HG13 ' A' ' 117' ' ' VAL . 15.1 pt-20 . . . . . 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.129999999999995 110.94 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.577 0 N-CA-C 109.911 -0.403 . . . . 73.140000000000001 109.911 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.540000000000006 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.340000000000003 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.530000000000001 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.549999999999997 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 52.210000000000001 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 71.420000000000002 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 64.340000000000003 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.350000000000001 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.400000000000006 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.430000000000007 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.540000000000006 110.299 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 121.128 0.49 . . . . 32.109999999999999 111.716 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 13.220000000000001 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.340000000000003 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.420000000000002 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.129999999999995 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.150000000000006 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.119999999999997 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.300000000000001 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.200000000000003 112.208 -178.567 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 121.06 0.457 . . . . 72.140000000000001 111.248 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.450000000000003 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.209999999999994 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.239999999999995 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.409999999999997 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.109999999999999 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.030000000000001 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.209999999999994 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.510000000000005 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.150000000000006 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 52.439999999999998 111.364 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.251 -0.648 . . . . 74.450000000000003 109.251 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.109999999999999 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.329999999999998 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.020000000000003 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.423 ' HB2' ' HB2' ' A' ' 67' ' ' SER . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.439999999999998 111.732 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.530000000000001 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.140000000000001 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' PRO . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.230000000000004 111.262 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.450000000000003 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.340000000000003 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.209999999999994 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.299999999999997 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.140000000000001 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.409999999999997 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.200000000000003 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.210000000000001 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.549999999999997 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.579 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.319999999999993 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.310000000000002 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.420000000000002 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.439999999999998 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.319999999999993 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 65.239999999999995 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.340000000000003 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.399999999999999 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.319999999999993 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.010000000000005 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.430000000000007 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.230000000000004 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.409999999999997 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.529 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.519999999999996 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.319999999999993 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.526 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.019999999999996 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.200000000000003 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.349999999999994 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.510000000000005 107.949 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.644 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.239999999999995 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.329999999999998 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 71.219999999999999 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.310000000000002 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.569 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.299999999999997 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.530000000000001 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.020000000000003 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.310000000000002 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.210000000000001 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.230000000000004 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.150000000000006 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.439999999999998 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.120000000000005 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.219999999999999 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.651 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.299999999999997 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.129999999999995 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 52.450000000000003 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.4 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.439999999999998 109.703 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 118' ' ' SER . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.209999999999994 112.471 177.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 73.329999999999998 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.120000000000005 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.319999999999993 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 62.399999999999999 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.430000000000007 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 44.32 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.319999999999993 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.150000000000006 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 41.539999999999999 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.329999999999998 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.540000000000006 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.239999999999995 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.578 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.030000000000001 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.329999999999998 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.200000000000003 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.030000000000001 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.539999999999999 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.039999999999999 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.510000000000005 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.119999999999997 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.109999999999999 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 64.0 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.239999999999995 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.447 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.420000000000002 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.040000000000006 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.019999999999996 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.049999999999997 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.636 HE21 ' HA ' ' A' ' 147' ' ' GLN . 0.1 OUTLIER -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.109999999999999 109.648 177.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.030000000000001 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 61.219999999999999 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.010000000000005 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.219999999999999 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 61.020000000000003 110.163 178.066 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 120.884 0.373 . . . . 62.329999999999998 110.495 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.030000000000001 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.450000000000003 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.430000000000007 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.240000000000002 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.549999999999997 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.319999999999993 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.210000000000001 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . 0.46 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 63.520000000000003 109.083 -179.038 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 120.905 0.383 . . . . 74.409999999999997 110.47 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.150000000000006 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 60.43 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.329999999999998 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.219999999999999 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.030000000000001 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.019999999999996 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.209999999999994 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo . . . . . 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.229999999999997 111.549 179.097 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.446 -0.67 0 CA-C-O 121.1 0.476 . . . . 62.530000000000001 110.087 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.400000000000006 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.420000000000002 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.239999999999995 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.119999999999997 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.140000000000001 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.329999999999998 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.520000000000003 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.510000000000005 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.019999999999996 112.043 -179.345 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.916 0.389 . . . . 54.240000000000002 110.844 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.409999999999997 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.450000000000003 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.140000000000001 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.020000000000003 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 62.240000000000002 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.120000000000005 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 62.299999999999997 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.55 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.420000000000002 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.129999999999995 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.109999999999999 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.409999999999997 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.319999999999993 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.439999999999998 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.63 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.230000000000004 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.329999999999998 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.310000000000002 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.310000000000002 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.329999999999998 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.329999999999998 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 74.329999999999998 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.509999999999998 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.319999999999993 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.349999999999994 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.420000000000002 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.130000000000003 111.475 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.409999999999997 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.329999999999998 109.705 -177.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.209999999999994 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.340000000000003 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.453 HD13 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 62.219999999999999 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.129999999999995 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 101' ' ' VAL . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.229999999999997 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.672 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.329999999999998 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.672 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.130000000000003 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.129999999999995 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 44.130000000000003 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.099999999999994 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.592 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.549999999999997 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.299999999999997 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 93' ' ' LEU . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.210000000000001 108.883 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.230000000000004 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.409 HG22 ' N ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.140000000000001 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 64.239999999999995 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.219999999999999 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.109999999999999 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.519999999999996 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.239999999999995 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.519999999999996 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.299999999999997 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.130000000000003 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.120000000000005 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 26.7 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 54.210000000000001 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.530000000000001 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 61.229999999999997 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.130000000000003 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.439999999999998 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 73.299999999999997 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.200000000000003 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.200000000000003 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.319999999999993 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.524 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.129999999999995 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.400000000000006 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.010000000000005 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 73.099999999999994 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 64.25 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.53 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.219999999999999 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.420000000000002 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.48 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.340000000000003 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.340000000000003 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 63.439999999999998 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.319999999999993 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.130000000000003 110.049 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.130000000000003 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.140000000000001 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.439999999999998 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.310000000000002 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.519999999999996 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.530000000000001 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.240000000000002 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.129999999999995 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.229999999999997 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 54.240000000000002 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.340000000000003 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.219999999999999 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.409999999999997 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.530000000000001 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.420000000000002 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.409999999999997 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.239999999999995 110.41 178.423 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.227 -0.286 . . . . 74.530000000000001 110.227 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.119999999999997 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.329999999999998 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.230000000000004 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.230000000000004 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.409999999999997 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 45.140000000000001 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.210000000000001 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.219999999999999 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.119999999999997 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 166' ' ' GLN . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.299999999999997 109.959 178.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 CA--C 1.509 -0.611 0 N-CA-C 108.981 -0.748 . . . . 73.109999999999999 108.981 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 51.350000000000001 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.340000000000003 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.439999999999998 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.230000000000004 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.120000000000005 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.020000000000003 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.329999999999998 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.140000000000001 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.140000000000001 111.846 179.638 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.057 0.456 . . . . 71.099999999999994 110.989 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.430000000000007 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 42.039999999999999 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.539999999999999 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.549999999999997 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.450000000000003 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.240000000000002 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.319999999999993 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.439999999999998 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.209999999999994 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.439999999999998 110.401 -178.793 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.318 -0.623 . . . . 72.530000000000001 109.318 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 71.450000000000003 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.120000000000005 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.200000000000003 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.340000000000003 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.329999999999998 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.219999999999999 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.129999999999995 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 64.439999999999998 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.319999999999993 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.417 ' HE1' HD22 ' A' ' 93' ' ' LEU . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.540000000000006 109.81 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.25 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.120000000000005 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.230000000000004 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.129999999999995 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.329999999999998 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.100000000000001 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.310000000000002 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.606 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 73.340000000000003 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.439999999999998 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.439999999999998 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.349999999999994 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 60.100000000000001 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.329999999999998 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.040000000000006 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.130000000000003 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.510000000000005 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.439999999999998 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.140000000000001 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 47.6 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.219999999999999 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.540000000000006 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.120000000000005 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.417 HD22 ' HE1' ' A' ' 70' ' ' TRP . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.319999999999993 110.246 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 61.119999999999997 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.130000000000003 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.130000000000003 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.120000000000005 108.542 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.030000000000001 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.540000000000006 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.129999999999995 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.049999999999997 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.329999999999998 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.229999999999997 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.516 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 60.149999999999999 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.566 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.299999999999997 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.239999999999995 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.430000000000007 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.530000000000001 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.140000000000001 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.530000000000001 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.219999999999999 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.566 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.299999999999997 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.420000000000002 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.420000000000002 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.219999999999999 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.430000000000007 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.099999999999994 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 33.32 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 61.310000000000002 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.310000000000002 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.040000000000006 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.239999999999995 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 51.32 110.371 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.120000000000005 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.229999999999997 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 54.130000000000003 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.219999999999999 110.267 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.329999999999998 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.409999999999997 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 65.129999999999995 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 51.109999999999999 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.349999999999994 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 70.0 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.432 ' HB3' HD12 ' A' ' 145' ' ' LEU . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.230000000000004 111.308 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.409999999999997 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.120000000000005 111.291 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.409999999999997 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.340000000000003 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.319999999999993 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 62.020000000000003 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.239999999999995 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 61.219999999999999 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.436 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.430000000000007 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.432 HD12 ' HB3' ' A' ' 135' ' ' ARG . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.109999999999999 111.149 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.539999999999999 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.109999999999999 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.010000000000005 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 51.219999999999999 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.409999999999997 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.409999999999997 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' SER . . . . . 0.793 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.299999999999997 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.510000000000005 110.091 -176.845 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.942 -0.392 . . . . 63.409999999999997 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.109999999999999 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.430000000000007 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.209999999999994 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 64.530000000000001 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.109999999999999 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.310000000000002 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.299999999999997 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.119999999999997 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.409999999999997 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.350000000000001 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.230000000000004 110.295 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.443 ' CD2' ' HG3' ' A' ' 2' ' ' MET . 76.0 t60 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.851 -0.426 . . . . 70.140000000000001 109.851 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.443 ' HG3' ' CD2' ' A' ' 1' ' ' HIS . 71.1 mtm 73.8 171.08 0.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.502 0.721 . . . . 71.540000000000006 111.08 -177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.11 153.85 3.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 62.240000000000002 110.537 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.1 p -159.84 104.94 1.57 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.13 -0.487 . . . . 43.229999999999997 110.571 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.08 -62.02 1.7 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.995 -0.548 . . . . 70.230000000000004 110.423 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.8 t70 67.71 118.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.347 -0.842 . . . . 63.509999999999998 111.667 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.05 168.23 9.99 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.837 -0.62 . . . . 73.150000000000006 110.583 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -165.66 -6.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.243 0.46 . . . . 60.549999999999997 112.243 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.6 m -87.77 115.23 25.08 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.843 0.354 . . . . 75.319999999999993 111.067 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.71 104.93 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.821 -0.704 . . . . 65.420000000000002 111.848 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.29 154.34 68.61 Favored 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.818 2.345 . . . . 74.340000000000003 112.088 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.3 84.52 0.3 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.095 -0.502 . . . . 61.240000000000002 110.857 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.8 mt -152.19 149.75 29.09 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.184 -0.673 . . . . 61.439999999999998 109.184 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 60.7 m -88.11 117.49 68.48 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-O 120.587 0.232 . . . . 74.129999999999995 111.258 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 14' ' ' THR . 6.0 Cg_exo -79.8 137.76 12.84 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.528 2.152 . . . . 34.25 110.938 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.0 tp -161.67 115.52 1.91 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.846 0.355 . . . . 63.0 110.495 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 p -152.21 102.32 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-O 121.43 0.633 . . . . 44.200000000000003 110.466 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.78 131.02 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.97 -0.559 . . . . 74.409999999999997 110.993 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.47 106.64 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.943 -0.571 . . . . 53.030000000000001 110.307 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -169.01 113.49 0.56 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.092 -0.504 . . . . 74.540000000000006 110.236 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.54 102.76 0.6 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 31.5 110.541 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.1 -178.67 4.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.9 -0.591 . . . . 74.519999999999996 110.046 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.5 t -153.5 175.94 12.6 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.827 -0.434 . . . . 65.540000000000006 109.827 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.6 t -164.87 119.45 1.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.204 -0.295 . . . . 71.239999999999995 110.204 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.19 75.2 0.12 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.884 -0.598 . . . . 71.219999999999999 110.353 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -162.16 153.77 18.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.938 -0.574 . . . . 64.109999999999999 110.015 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.3 t 72.95 147.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.217 0.607 . . . . 60.240000000000002 111.207 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 67.96 89.91 0.1 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.832 -0.622 . . . . 72.150000000000006 110.422 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.8 p -171.25 146.19 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 115.378 -0.828 . . . . 44.549999999999997 109.511 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.4 t70 70.03 167.07 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.022 0.529 . . . . 73.150000000000006 110.74 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -150.78 145.23 18.05 Favored Pre-proline 0 C--N 1.32 -0.703 0 O-C-N 122.228 -0.295 . . . . 65.319999999999993 110.752 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.48 143.28 68.66 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.039 2.493 . . . . 71.129999999999995 112.9 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.91 130.56 9.59 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 122.99 2.46 . . . . 54.009999999999998 112.393 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -74.65 120.72 82.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.992 -0.549 . . . . 40.530000000000001 111.401 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 18.6 Cg_exo -66.66 143.05 66.55 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.623 2.215 . . . . 74.230000000000004 111.835 178.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.9 m -145.12 145.46 20.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.197 -0.456 . . . . 63.200000000000003 110.231 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.1 m -151.37 139.04 19.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.493 -0.321 . . . . 73.120000000000005 110.273 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -117.0 166.32 12.33 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.209 -0.293 . . . . 71.430000000000007 110.209 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.53 -99.67 0.12 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 74.439999999999998 112.346 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 63.96 -172.51 0.17 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.095 0.558 . . . . 73.430000000000007 111.508 -179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.92 -30.32 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.375 -0.375 . . . . 71.420000000000002 110.946 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.9 mtp 65.91 99.11 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.496 0 C-N-CA 123.239 0.615 . . . . 74.549999999999997 111.672 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.68 112.57 1.51 Allowed 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 122.499 2.132 . . . . 64.420000000000002 111.587 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -83.94 154.48 23.35 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.038 -0.528 . . . . 75.120000000000005 109.882 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -147.85 118.33 7.44 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.665 -0.495 . . . . 53.229999999999997 109.665 -177.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.6 m -68.25 135.88 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.175 -0.466 . . . . 75.420000000000002 110.912 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 p -68.73 111.65 4.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.91 -0.586 . . . . 44.219999999999999 110.933 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.15 138.98 52.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.324 -0.398 . . . . 72.239999999999995 110.571 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.2 m -86.33 138.18 32.02 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.963 -0.562 . . . . 65.109999999999999 110.083 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.11 168.12 19.43 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.512 -0.551 . . . . 73.109999999999999 109.512 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -78.66 141.68 60.52 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.738 -0.467 . . . . 64.340000000000003 109.738 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 141.23 92.96 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.088 2.525 . . . . 70.519999999999996 111.978 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.448 ' O ' HD12 ' A' ' 53' ' ' LEU . 1.1 pp -77.49 135.23 65.22 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 116.304 -0.407 . . . . 62.399999999999999 111.356 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 33.5 Cg_exo -59.65 138.26 82.26 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.794 2.329 . . . . 73.230000000000004 111.582 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.0 m -147.43 -173.14 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.222 -0.445 . . . . 73.150000000000006 110.781 -177.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.04 -176.4 4.49 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.154 -0.684 . . . . 55.140000000000001 109.154 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -73.51 121.42 20.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.808 -0.442 . . . . 73.239999999999995 109.808 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 135.92 89.67 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.193 -0.458 . . . . 63.329999999999998 111.422 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.528 ' O ' HG22 ' A' ' 60' ' ' VAL . 43.9 Cg_endo -70.96 119.53 6.38 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.409 2.073 . . . . 74.049999999999997 110.267 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.528 HG22 ' O ' ' A' ' 59' ' ' PRO . 4.0 m 55.33 -176.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.068 0.947 . . . . 73.239999999999995 110.962 -175.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.607 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 26.1 tp -100.76 85.42 2.89 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.77 -0.772 . . . . 72.530000000000001 110.728 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.2 m -136.7 83.96 2.04 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.179 0.514 . . . . 64.340000000000003 111.745 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -133.44 161.11 65.77 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 108.823 -0.806 . . . . 65.530000000000001 108.823 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.6 138.9 48.56 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.544 2.162 . . . . 61.399999999999999 112.477 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.55 114.78 9.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.194 0.521 . . . . 52.310000000000002 110.575 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.12 -26.34 5.58 Favored Glycine 0 N--CA 1.439 -1.156 0 N-CA-C 111.195 -0.762 . . . . 73.109999999999999 111.195 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -61.9 139.15 58.4 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.829 0.347 . . . . 71.319999999999993 110.575 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -72.8 -29.0 62.92 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.876 -0.33 . . . . 75.040000000000006 110.437 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -58.31 -37.1 74.39 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.023 -0.535 . . . . 42.539999999999999 111.168 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.607 ' NE1' ' HG ' ' A' ' 61' ' ' LEU . 35.0 t90 -68.29 -38.82 82.05 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.925 0.393 . . . . 72.010000000000005 109.998 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -68.74 -46.89 67.69 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.117 -0.492 . . . . 75.319999999999993 110.614 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 85.5 mm-40 -56.55 -45.62 81.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.14 -0.482 . . . . 74.25 111.021 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.5 m -63.88 -40.19 95.93 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.433 -0.349 . . . . 72.030000000000001 110.384 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 56.3 t80 -54.05 -44.68 71.28 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 110.913 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.425 ' HA ' HD13 ' A' ' 134' ' ' LEU . 43.0 m -69.11 -39.45 78.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.622 -0.263 . . . . 74.420000000000002 111.31 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 20.4 mm-40 -53.17 -50.87 63.71 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.312 -0.403 . . . . 71.010000000000005 111.835 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 25.1 pt20 -58.05 -34.7 70.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.531 -0.304 . . . . 55.0 111.558 -177.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 42.0 t -75.98 -34.26 26.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.862 -0.421 . . . . 75.549999999999997 109.862 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 95.5 mmm -61.99 -43.79 98.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.395 -0.594 . . . . 75.219999999999999 109.395 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.4 mm? -64.15 -43.13 96.14 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.068 -0.514 . . . . 54.030000000000001 111.273 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -55.04 -51.17 67.14 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.572 0.225 . . . . 74.340000000000003 111.264 177.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.3 t -65.88 -27.36 68.16 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.448 -0.342 . . . . 64.099999999999994 111.603 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.699 ' HG3' ' O ' ' A' ' 79' ' ' MET . 73.7 mtp180 -72.6 -36.72 68.17 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 70.439999999999998 110.773 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.01 -32.1 61.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.19 0.519 . . . . 70.150000000000006 110.693 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.65 -2.36 32.27 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.464 -0.874 . . . . 33.409999999999997 111.955 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -81.2 -170.09 2.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.637 -0.505 . . . . 74.540000000000006 109.637 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.688 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 7.7 pt20 -166.41 -29.68 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.88 0.371 . . . . 71.310000000000002 111.043 -177.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 15.7 m -101.52 135.94 42.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.418 -0.586 . . . . 63.420000000000002 109.418 176.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.43 165.94 33.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.789 0.328 . . . . 75.549999999999997 111.649 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.19 163.48 14.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.449 -0.945 . . . . 72.109999999999999 108.449 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 100' ' ' GLN . 55.7 tp -160.42 138.12 9.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.494 -0.482 . . . . 70.340000000000003 111.831 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.461 ' NH1' ' HA2' ' A' ' 99' ' ' GLY . 17.4 mmt180 -74.26 121.52 21.42 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.336 -0.616 . . . . 74.209999999999994 109.336 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 81.0 mt -138.55 160.8 38.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.466 0.65 . . . . 63.530000000000001 111.626 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.619 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 63.1 m170 -100.67 148.87 35.59 Favored Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 114.567 -1.197 . . . . 73.239999999999995 109.454 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.619 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 44.4 Cg_exo -58.88 136.21 12.81 Favored 'Cis proline' 0 C--N 1.355 0.891 0 C-N-CA 123.988 -1.255 . . . . 64.439999999999998 113.029 0.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.68 -38.03 1.32 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.614 0.968 . . . . 53.149999999999999 113.614 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 9.9 pt-20 -48.93 -24.56 1.53 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.254 0.835 . . . . 73.219999999999999 113.254 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 95' ' ' PRO . 39.2 mt -65.27 -33.93 77.14 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.81 0.338 . . . . 61.219999999999999 110.591 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.461 ' HA2' ' NH1' ' A' ' 92' ' ' ARG . . . 64.13 -45.31 0.1 OUTLIER Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.842 1.097 . . . . 70.140000000000001 115.842 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 100' ' ' GLN . 5.2 pm0 -168.08 111.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.808 0.804 . . . . 71.510000000000005 110.412 -176.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 117' ' ' VAL . 74.9 t -87.32 154.91 3.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 O-C-N 121.045 -1.035 . . . . 65.420000000000002 110.047 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -102.26 107.34 18.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 116.086 -0.507 . . . . 74.420000000000002 109.839 -176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 88' ' ' SER . 3.8 mp -94.58 117.32 38.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.557 -0.534 . . . . 64.310000000000002 109.557 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.0 m -127.71 95.47 4.24 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.015 0.436 . . . . 72.409999999999997 111.585 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 33.7 tp -88.85 119.57 29.48 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.977 -0.556 . . . . 72.109999999999999 109.697 176.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 1.0 OUTLIER -92.05 154.64 18.62 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.736 -0.468 . . . . 72.010000000000005 109.736 178.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 34.0 tp -133.27 121.33 22.29 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.951 0.405 . . . . 63.130000000000003 111.011 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -143.55 136.17 27.29 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.924 -0.769 . . . . 72.400000000000006 108.924 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.6 t70 49.78 -91.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.579 0.549 . . . . 52.299999999999997 111.499 -175.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -148.71 24.11 0.98 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.061 0.934 . . . . 71.310000000000002 108.899 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.6 pt20 -125.75 128.78 48.27 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.334 -0.848 . . . . 73.439999999999998 109.807 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -105.97 130.75 53.85 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.883 -0.599 . . . . 72.340000000000003 112.199 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 52.0 tt0 -99.55 112.17 24.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.48 -0.782 . . . . 60.310000000000002 109.661 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.0 tp -94.56 107.07 19.07 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.913 0.387 . . . . 74.420000000000002 111.651 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -105.34 135.71 46.21 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.068 -0.515 . . . . 61.210000000000001 110.3 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 62.2 mtm -137.88 139.15 39.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.405 -0.361 . . . . 73.109999999999999 110.476 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.638 ' HA ' ' O ' ' A' ' 151' ' ' SER . 95.9 t -106.37 104.43 17.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.149 -0.478 . . . . 73.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 25.0 p -157.74 145.71 13.97 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 116.097 -0.501 . . . . 61.149999999999999 110.459 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.688 ' HA ' ' OG ' ' A' ' 152' ' ' SER . 38.4 Cg_exo -63.4 174.06 3.77 Favored 'Trans proline' 0 N--CA 1.482 0.8 0 C-N-CA 123.441 2.761 . . . . 74.099999999999994 113.481 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -87.6 117.1 26.18 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.026 -0.534 . . . . 75.349999999999994 110.03 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -155.64 171.75 19.45 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.963 -0.754 . . . . 45.210000000000001 108.963 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -61.76 -17.59 56.55 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.964 0.411 . . . . 55.229999999999997 110.677 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 94' ' ' HIS . 42.7 t -60.48 -36.58 70.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.909 -0.587 . . . . 72.349999999999994 110.114 177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -65.25 -35.77 82.08 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.025 -0.534 . . . . 65.109999999999999 110.532 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.38 -58.21 8.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.377 -0.374 . . . . 71.129999999999995 111.288 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.47 -31.14 65.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 112.008 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -69.51 -48.24 61.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.422 . . . . 73.200000000000003 109.869 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.05 -38.57 91.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.914 -0.585 . . . . 74.140000000000001 110.121 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.522 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.07 -26.65 68.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 74.150000000000006 111.321 177.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.5 -12.37 59.87 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.234 -0.439 . . . . 72.5 111.82 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.7 mt -64.95 -49.03 70.29 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 112.039 0.385 . . . . 74.549999999999997 112.039 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 47.4 Cg_exo -59.2 -22.93 67.13 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 121.92 1.747 . . . . 74.219999999999999 111.713 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 53.4 ttp -83.28 -35.75 25.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.38 0.61 . . . . 70.329999999999998 109.566 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 75' ' ' SER . 66.2 tp -65.33 -44.14 88.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.267 -0.879 . . . . 72.530000000000001 110.531 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -56.52 -29.29 61.7 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 111.106 177.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.418 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 7.5 m -73.05 -39.15 66.17 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.793 0.33 . . . . 53.210000000000001 110.49 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -68.83 -47.18 66.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.201 -0.454 . . . . 74.540000000000006 110.448 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.0 mt -66.05 -34.62 78.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 60.329999999999998 110.988 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -58.35 -31.26 67.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.895 -0.593 . . . . 70.010000000000005 111.107 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.5 mt-10 -71.07 -19.96 62.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.958 -0.564 . . . . 74.349999999999994 110.806 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 12.6 t -96.15 -3.83 43.77 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.185 0.516 . . . . 70.549999999999997 109.976 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 110.9 -34.37 5.38 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.773 -0.727 . . . . 64.340000000000003 113.29 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 143' ' ' ILE . 4.0 mp -82.05 153.44 4.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 120.943 0.401 . . . . 74.409999999999997 110.881 -177.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.7 mt-30 -122.1 120.36 34.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 74.219999999999999 110.49 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.63 105.72 5.86 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.963 -0.755 . . . . 73.0 108.963 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -98.78 -61.98 0.86 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.443 -0.884 . . . . 52.409999999999997 112.959 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.52 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 6.6 tp-100 -103.06 148.73 25.35 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.148 0.499 . . . . 72.230000000000004 110.867 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.8 m -147.66 146.97 29.51 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 109.273 -0.64 . . . . 55.009999999999998 109.273 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 32.8 m -149.19 143.4 25.91 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.911 0.386 . . . . 75.439999999999998 110.813 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 68.3 mt -131.7 123.35 51.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.084 -0.709 . . . . 63.140000000000001 109.084 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.638 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 15.2 m -140.18 145.17 37.13 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.506 -0.553 . . . . 72.439999999999998 109.506 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.688 ' OG ' ' HA ' ' A' ' 119' ' ' PRO . 6.0 m -81.62 -26.74 34.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.435 0.636 . . . . 63.119999999999997 109.526 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -152.84 -46.84 0.1 Allowed 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.718 -1.128 . . . . 43.539999999999999 109.198 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 69.9 m -155.55 152.45 28.84 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.933 -0.765 . . . . 71.409999999999997 108.933 177.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . 0.467 ' HB2' ' OG ' ' A' ' 151' ' ' SER . 60.4 t80 -100.76 127.31 47.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.899 0.38 . . . . 72.120000000000005 110.833 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.92 118.85 3.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.748 -0.66 . . . . 55.140000000000001 109.748 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.4 62.45 0.35 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.761 -0.733 . . . . 75.540000000000006 111.65 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -77.24 83.07 3.71 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 110.844 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -160.54 120.86 2.85 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.318 -0.855 . . . . 74.230000000000004 109.474 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -149.3 107.42 3.74 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.033 0.444 . . . . 73.209999999999994 110.409 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.4 m -154.72 123.31 6.11 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.455 -0.793 . . . . 33.119999999999997 109.237 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.3 m -162.79 33.65 0.1 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.831 0.348 . . . . 61.219999999999999 110.403 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 10.7 p -67.46 97.64 0.6 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.187 -0.46 . . . . 72.319999999999993 110.427 178.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 165' ' ' GLN . 43.1 tt0 -162.9 -179.04 6.49 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.337 -0.986 . . . . 74.209999999999994 108.337 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . 0.581 ' H ' ' HG2' ' A' ' 164' ' ' GLN . 2.9 mp0 71.55 75.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.295 0.569 . . . . 64.310000000000002 111.722 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -120.83 102.79 8.6 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.194 -0.912 . . . . 72.140000000000001 108.897 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.8 p -170.66 179.8 3.15 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 116.318 -0.401 . . . . 71.230000000000004 110.635 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -160.68 -174.06 4.26 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.154 -0.475 . . . . 64.510000000000005 109.825 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 . . . . . 0 C--O 1.252 1.203 0 CA-C-O 118.385 -0.817 . . . . 74.439999999999998 110.164 177.655 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.1 m80 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.704 0.287 . . . . 72.439999999999998 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -87.47 139.85 30.13 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.705 -0.479 . . . . 64.209999999999994 109.705 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.16 -152.68 0.08 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.911 -0.403 . . . . 62.43 109.911 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.0 p -156.63 -170.58 3.37 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.599 -0.519 . . . . 54.450000000000003 109.599 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -79.01 -39.54 33.8 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.559 -0.456 . . . . 62.240000000000002 110.262 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.6 t70 59.44 92.72 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.583 -0.735 . . . . 63.43 111.514 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -139.75 150.42 44.77 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.911 -0.586 . . . . 75.409999999999997 111.346 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -166.7 134.13 2.58 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.93 -0.577 . . . . 74.140000000000001 109.764 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -150.43 149.02 29.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.829 0.347 . . . . 74.319999999999993 110.519 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -148.68 75.66 0.26 Allowed Glycine 0 N--CA 1.441 -0.989 0 C-N-CA 120.743 -0.742 . . . . 64.400000000000006 112.116 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.79 145.0 40.09 Favored 'Trans proline' 0 C--O 1.238 0.513 0 C-N-CA 123.084 2.523 . . . . 62.210000000000001 111.829 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.64 134.67 4.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.117 -0.492 . . . . 73.510000000000005 110.506 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.8 mt -151.92 161.91 41.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.14 -0.482 . . . . 72.120000000000005 109.771 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 35.7 m -84.72 119.1 72.41 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.484 -0.325 . . . . 74.420000000000002 110.303 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -79.45 167.38 21.18 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.219 1.946 . . . . 74.439999999999998 111.227 178.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.412 ' O ' HD12 ' A' ' 16' ' ' LEU . 2.2 pp -160.92 152.99 20.01 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.818 0.342 . . . . 72.420000000000002 110.936 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.07 176.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 115.968 -0.56 . . . . 70.530000000000001 110.801 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.2 p -152.8 118.87 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.032 0.444 . . . . 65.420000000000002 110.413 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.24 128.9 1.6 Allowed 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.192 -0.458 . . . . 65.040000000000006 110.838 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.97 103.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.707 -0.679 . . . . 65.140000000000001 110.086 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.69 135.35 1.48 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.756 -0.461 . . . . 63.140000000000001 109.756 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.23 161.64 19.42 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.812 0.339 . . . . 63.149999999999999 110.507 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -152.96 103.9 2.79 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 121.41 0.624 . . . . 52.409999999999997 110.453 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m -161.97 109.94 1.41 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 71.319999999999993 110.483 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.48 -6.12 52.4 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 110.075 -0.343 . . . . 55.299999999999997 110.075 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 74.53 31.53 0.99 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.345 -0.843 . . . . 73.030000000000001 109.728 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.9 26.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 115.2 -0.909 . . . . 72.430000000000007 109.938 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -76.55 97.1 4.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.52 -0.764 . . . . 60.509999999999998 110.523 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.2 p -169.88 142.08 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.151 -0.477 . . . . 54.340000000000003 110.419 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -154.98 144.02 20.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.282 -0.417 . . . . 71.219999999999999 110.397 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -151.71 95.46 3.26 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.283 -0.417 . . . . 74.109999999999999 110.115 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.25 133.68 29.19 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.723 2.282 . . . . 71.150000000000006 111.523 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.48 133.81 44.8 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.38 2.053 . . . . 74.040000000000006 111.417 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.79 120.7 77.73 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.272 -0.422 . . . . 75.099999999999994 110.974 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HB2' ' H ' ' A' ' 36' ' ' VAL . 85.5 Cg_endo -85.26 -144.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.01 2.473 . . . . 72.450000000000003 110.7 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 35' ' ' PRO . 18.9 m -75.19 121.1 26.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.261 0.553 . . . . 65.400000000000006 109.597 178.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.3 p -85.59 97.2 9.95 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.427 0.632 . . . . 73.310000000000002 112.504 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -126.52 149.53 49.32 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.727 -0.669 . . . . 74.120000000000005 109.752 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 95.2 80.42 1.51 Allowed Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.467 -0.873 . . . . 72.349999999999994 111.617 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -163.46 38.4 0.09 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.428 0.633 . . . . 64.400000000000006 109.429 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 57.7 0.22 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.042 -0.981 . . . . 74.140000000000001 109.343 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.63 153.0 64.46 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.011 -0.995 . . . . 41.439999999999998 110.274 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.44 121.85 9.0 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.618 2.212 . . . . 71.109999999999999 112.116 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -81.69 142.46 32.67 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.785 -0.643 . . . . 64.450000000000003 110.113 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 91.9 mt -146.7 -176.53 5.23 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.765 -0.457 . . . . 74.109999999999999 109.765 -178.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.0 m -159.6 144.55 15.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.952 0.406 . . . . 72.400000000000006 110.61 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 21.5 m -102.55 174.42 5.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.958 -0.565 . . . . 72.319999999999993 109.97 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.41 90.32 2.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.233 0.539 . . . . 74.230000000000004 110.491 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 20.1 m -86.73 93.72 9.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.517 -0.765 . . . . 75.310000000000002 110.824 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -167.96 143.55 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 70.510000000000005 110.175 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.34 146.68 40.41 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.69 -0.232 . . . . 72.439999999999998 110.454 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.03 165.19 28.65 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.439 2.093 . . . . 72.340000000000003 110.847 176.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.5 mt -94.7 143.4 26.15 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-O 120.712 0.291 . . . . 72.040000000000006 110.734 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.26 127.15 9.64 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.706 2.271 . . . . 32.25 112.319 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.5 p -84.86 161.59 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.512 -0.551 . . . . 75.420000000000002 109.512 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.85 156.69 25.47 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.284 -0.265 . . . . 52.329999999999998 110.284 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -77.84 157.37 29.93 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.108 -0.496 . . . . 74.439999999999998 111.211 -178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.37 149.42 91.37 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 43.509999999999998 110.249 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.52 154.64 72.82 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 122.433 2.089 . . . . 52.439999999999998 111.789 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.5 162.02 2.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.076 0.465 . . . . 75.109999999999999 111.166 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 93' ' ' LEU . 41.9 tp -94.2 93.83 8.0 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.93 -0.577 . . . . 72.450000000000003 110.527 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 m -128.62 81.6 2.04 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.518 0.675 . . . . 53.340000000000003 110.375 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.7 160.37 66.74 Favored Pre-proline 0 C--N 1.307 -1.278 0 CA-C-N 114.987 -1.006 . . . . 74.319999999999993 109.169 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.86 131.12 40.07 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.305 2.003 . . . . 74.430000000000007 111.508 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.57 HD23 ' H ' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -71.3 123.14 21.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.106 0.479 . . . . 74.019999999999996 110.644 -178.526 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.89 -34.07 5.42 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.786 -0.926 . . . . 74.150000000000006 110.786 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.1 t -62.14 149.71 40.66 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.292 -0.454 . . . . 71.420000000000002 110.658 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -66.27 -28.45 68.72 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 63.299999999999997 110.283 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -59.74 -42.28 92.84 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.063 -0.517 . . . . 64.439999999999998 110.804 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 92.7 t90 -67.42 -41.26 85.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.121 -0.491 . . . . 73.099999999999994 109.998 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -63.4 -49.56 73.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.111 -0.495 . . . . 62.219999999999999 110.646 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -57.9 -47.19 83.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.092 -0.504 . . . . 74.310000000000002 111.677 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.4 m -64.89 -42.57 94.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.724 0.297 . . . . 64.150000000000006 110.405 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.12 -48.06 76.93 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.266 -0.425 . . . . 75.340000000000003 110.327 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.2 m -56.53 -44.81 81.2 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.082 -0.508 . . . . 64.530000000000001 111.318 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -53.88 -45.31 71.01 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.545 -0.298 . . . . 73.319999999999993 111.455 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -58.64 -40.33 83.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.312 -0.404 . . . . 72.129999999999995 110.832 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.487 HG11 HD21 ' A' ' 134' ' ' LEU . 36.7 t -77.49 -30.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.327 . . . . 73.310000000000002 110.651 -177.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.467 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 90.9 mtp -63.95 -51.96 61.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.321 -0.622 . . . . 73.450000000000003 109.321 176.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.6 tp -60.63 -41.2 94.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.191 0.519 . . . . 64.430000000000007 109.703 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.531 ' CE2' ' HB2' ' A' ' 105' ' ' LEU . 85.8 t80 -51.23 -55.22 19.23 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.877 0.871 . . . . 73.140000000000001 111.362 177.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.2 t -70.1 -30.65 67.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.465 -0.334 . . . . 71.340000000000003 111.486 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.6 mtt180 -70.04 -41.21 74.52 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.659 0.266 . . . . 75.420000000000002 111.22 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.08 -22.89 48.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.012 0.435 . . . . 52.030000000000001 110.541 178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.32 27.75 65.26 Favored Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 115.765 -0.652 . . . . 64.510000000000005 112.866 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.41 HE21 ' HD1' ' A' ' 81' ' ' PHE . 9.4 pt20 -79.78 115.62 19.49 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.667 0.27 . . . . 72.239999999999995 110.336 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.547 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.2 pt20 -61.46 -20.27 62.94 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.036 0.754 . . . . 73.530000000000001 113.036 -177.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.0 m -148.87 146.48 27.95 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.85 0.357 . . . . 61.020000000000003 110.816 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -150.86 147.56 27.39 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.276 -0.42 . . . . 72.329999999999998 110.863 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -102.48 120.55 40.72 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.865 -0.607 . . . . 63.229999999999997 109.839 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 103' ' ' ILE . 48.2 tp -102.95 169.52 8.53 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.464 -0.569 . . . . 63.219999999999999 109.464 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 99' ' ' GLY . 23.7 tpt180 -118.93 117.5 29.0 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.195 -1.409 . . . . 73.129999999999995 107.195 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -130.19 146.15 51.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.474 0.654 . . . . 74.049999999999997 112.437 -172.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.553 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 50.7 m170 -101.65 157.2 34.14 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 114.782 -1.099 . . . . 74.219999999999999 109.604 175.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 18.2 Cg_endo -59.35 151.25 43.49 Favored 'Cis proline' 0 C--N 1.353 0.796 0 C-N-CA 124.316 -1.118 . . . . 70.239999999999995 113.939 1.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -36.1 1.08 Allowed 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.066 -1.424 . . . . 73.519999999999996 112.484 178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -50.55 -47.66 57.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.919 0.488 . . . . 75.150000000000006 111.774 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.03 -36.63 84.63 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.747 0.308 . . . . 75.420000000000002 110.266 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 92' ' ' ARG . . . 65.6 -42.69 0.14 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 116.447 1.339 . . . . 54.340000000000003 116.447 177.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -157.85 175.69 13.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 118.43 1.115 . . . . 64.430000000000007 112.229 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 91' ' ' LEU . 57.3 t -143.91 138.35 24.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.829 -1.078 . . . . 63.210000000000001 108.575 177.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -97.81 103.62 15.58 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.6 -0.519 . . . . 73.430000000000007 109.6 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.422 HD11 HD22 ' A' ' 91' ' ' LEU . 56.3 mt -92.3 111.84 24.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 120.967 0.413 . . . . 75.530000000000001 110.633 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.565 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.5 m -98.15 173.33 7.07 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.414 -0.812 . . . . 72.519999999999996 110.796 178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 62.3 tp -146.57 116.47 7.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.44 -0.345 . . . . 70.340000000000003 110.634 -175.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 22.8 tptm -114.05 130.69 56.55 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.496 -0.927 . . . . 73.420000000000002 108.496 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 61.6 tp -130.24 123.46 30.2 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 120.812 0.339 . . . . 70.299999999999997 110.223 -176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -133.85 123.21 24.37 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.981 -0.748 . . . . 74.540000000000006 108.981 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 48.09 -81.59 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 114.209 1.188 . . . . 73.439999999999998 114.209 -175.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -142.89 26.1 1.73 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.102 0.477 . . . . 64.109999999999999 110.886 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -133.22 142.99 48.85 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.983 -0.553 . . . . 72.209999999999994 109.914 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.519 ' O ' HD12 ' A' ' 145' ' ' LEU . . . -118.47 128.99 55.12 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.806 0.336 . . . . 74.430000000000007 111.407 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.1 tt0 -104.68 120.67 41.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.994 -0.548 . . . . 65.439999999999998 109.672 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.76 110.52 22.37 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.168 -0.469 . . . . 64.120000000000005 111.098 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.565 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 12.8 mt-30 -94.73 128.93 41.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.305 -0.998 . . . . 61.420000000000002 108.305 176.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.2 mtm -137.73 144.82 41.89 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.634 0.254 . . . . 72.400000000000006 110.629 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 64.6 t -119.17 116.28 50.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.196 -0.456 . . . . 63.340000000000003 111.09 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 152' ' ' SER . 17.3 p -160.71 144.94 10.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 N-CA-C 109.113 -0.699 . . . . 53.219999999999999 109.113 178.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -67.31 173.49 8.57 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 122.568 2.179 . . . . 73.120000000000005 112.29 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -89.4 127.8 35.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.095 0.474 . . . . 74.129999999999995 110.219 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 24.7 t -174.05 -175.0 0.97 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.09 -1.078 . . . . 72.120000000000005 108.09 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -68.17 -20.75 64.9 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 121.017 -0.273 . . . . 62.130000000000003 110.744 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.2 -39.32 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 N-CA-C 109.804 -0.443 . . . . 63.310000000000002 109.804 177.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.24 -33.78 76.52 Favored 'General case' 0 N--CA 1.458 -0.046 0 CA-C-N 116.138 -0.483 . . . . 72.340000000000003 110.143 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.96 87.86 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.262 0.553 . . . . 71.430000000000007 109.75 176.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.75 -33.64 72.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.634 -0.712 . . . . 75.430000000000007 110.886 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -61.87 -48.87 78.55 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.092 -0.707 . . . . 64.099999999999994 109.092 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -60.99 -44.01 98.01 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.755 -0.657 . . . . 74.230000000000004 110.309 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.33 -24.12 67.15 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.302 0.482 . . . . 73.409999999999997 112.302 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.32 -19.32 53.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.647 0.26 . . . . 62.240000000000002 111.65 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.457 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 95.1 mt -61.3 -53.3 63.96 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 112.69 0.626 . . . . 65.439999999999998 112.69 -176.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.6 Cg_endo -60.08 -25.87 80.94 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.128 1.885 . . . . 74.510000000000005 112.443 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 136' ' ' THR . 42.0 ttp -82.01 -32.53 30.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.45 0.643 . . . . 75.230000000000004 109.628 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 78' ' ' VAL . 60.4 tp -76.27 -43.59 41.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.363 -0.835 . . . . 74.120000000000005 111.334 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -55.23 -33.83 63.44 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.034 0.383 . . . . 65.439999999999998 112.034 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 133' ' ' MET . 15.2 t -73.36 -28.93 62.31 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.266 -0.574 . . . . 44.409999999999997 110.482 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 133' ' ' MET . 64.2 mm-40 -71.34 -45.58 62.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.212 -0.662 . . . . 72.349999999999994 109.212 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.99 -35.28 80.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.381 -0.827 . . . . 72.209999999999994 110.539 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.79 -34.83 75.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.91 -0.587 . . . . 73.299999999999997 111.07 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 136' ' ' THR . 56.4 mt-10 -77.76 -11.68 59.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.511 . . . . 71.540000000000006 110.907 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.9 t -97.33 -10.82 24.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.962 -0.563 . . . . 64.230000000000004 109.586 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.71 36.14 5.93 Favored Glycine 0 N--CA 1.44 -1.042 0 CA-C-N 115.622 -0.717 . . . . 75.099999999999994 111.525 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.1 mp -131.28 127.74 60.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.343 -0.614 . . . . 72.349999999999994 109.343 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -102.94 103.45 13.59 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.939 -0.393 . . . . 64.510000000000005 109.939 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 112' ' ' ALA . 53.2 tp -63.43 -84.2 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.125 -0.488 . . . . 74.019999999999996 110.554 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.82 -67.12 1.37 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.214 -0.517 . . . . 63.350000000000001 112.967 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 147' ' ' GLN . 6.3 tp60 -91.73 133.86 35.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.202 0.525 . . . . 65.450000000000003 110.794 -178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 16.9 m -142.07 143.69 33.2 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.876 -0.787 . . . . 72.530000000000001 108.876 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 16.5 m -133.51 131.63 40.03 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.833 0.349 . . . . 72.030000000000001 110.829 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.9 mt -130.87 103.9 8.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 116.03 -0.532 . . . . 73.230000000000004 109.832 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.1 t -99.15 159.15 15.18 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.207 -0.664 . . . . 61.43 109.207 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 118' ' ' SER . 19.6 m -84.07 -36.54 22.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.898 0.38 . . . . 61.340000000000003 110.614 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -162.04 -44.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 71.340000000000003 111.463 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 66.5 m -154.47 125.68 7.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.897 0.38 . . . . 74.200000000000003 111.042 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -103.57 108.28 19.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.117 -0.492 . . . . 62.409999999999997 109.742 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -84.85 145.67 27.71 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.392 -0.367 . . . . 73.5 111.004 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -144.02 155.11 26.07 Favored Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 111.227 -0.749 . . . . 60.539999999999999 111.227 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -159.38 138.4 11.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.09 0.472 . . . . 73.140000000000001 111.227 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -160.56 116.74 2.33 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.526 -0.761 . . . . 74.010000000000005 109.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -88.53 161.75 16.79 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.395 0.617 . . . . 61.149999999999999 112.395 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.8 t -145.25 158.85 43.73 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.211 -0.904 . . . . 74.310000000000002 108.706 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 28.8 t -165.66 148.19 7.57 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.885 0.374 . . . . 61.039999999999999 110.265 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 17.5 m -123.37 -173.37 2.71 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.855 -0.611 . . . . 51.009999999999998 110.216 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -152.62 140.08 19.64 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.902 -0.407 . . . . 60.439999999999998 109.902 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -79.23 165.04 23.68 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.251 0.548 . . . . 65.430000000000007 111.75 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -82.51 -173.3 4.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.3 -0.864 . . . . 70.439999999999998 109.692 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.4 t -165.29 -166.89 1.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.093 -0.336 . . . . 71.150000000000006 110.093 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.9 p -156.16 -173.06 4.34 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.698 -0.482 . . . . 74.420000000000002 109.698 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 169' ' ' ARG . 25.5 mtm180 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.65 -0.69 . . . . 75.010000000000005 109.905 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.385 -0.228 . . . . 75.5 110.385 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.7 mtm -86.02 90.72 8.18 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.106 0.479 . . . . 55.229999999999997 110.128 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.08 -33.95 76.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.636 -0.711 . . . . 60.329999999999998 110.977 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.7 m 62.62 96.51 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.927 -0.579 . . . . 62.420000000000002 111.203 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -79.46 -40.74 29.13 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.019 -0.537 . . . . 71.209999999999994 110.202 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.1 t70 71.03 124.86 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.287 -0.869 . . . . 62.100000000000001 111.727 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.67 ' HD3' ' N ' ' A' ' 8' ' ' ALA . 2.5 tmt_? -99.56 143.55 29.68 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.743 -0.836 . . . . 74.530000000000001 108.743 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.67 ' N ' ' HD3' ' A' ' 7' ' ' ARG . . . -65.4 163.09 16.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.106 0.479 . . . . 74.219999999999999 111.674 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.6 m -83.2 123.91 30.03 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.137 -0.483 . . . . 74.209999999999994 111.373 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.71 90.85 0.5 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 110.642 -0.983 . . . . 63.409999999999997 110.642 176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -70.08 90.7 0.55 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.649 2.232 . . . . 40.450000000000003 113.118 -177.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.53 153.93 30.87 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 64.310000000000002 109.97 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.4 141.79 17.54 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.74 0.305 . . . . 52.329999999999998 110.9 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -92.36 121.43 66.47 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.203 -0.453 . . . . 63.329999999999998 110.988 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -70.14 -166.97 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.584 2.189 . . . . 62.5 111.153 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -156.07 175.86 13.42 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.582 0.23 . . . . 53.240000000000002 110.526 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.78 144.44 9.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.214 -0.448 . . . . 72.510000000000005 111.07 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.7 p -86.35 146.25 6.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.091 -0.504 . . . . 73.299999999999997 110.234 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.29 157.64 15.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.192 -0.458 . . . . 74.200000000000003 110.168 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.74 -179.86 5.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.062 -0.517 . . . . 52.039999999999999 110.102 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -163.75 110.29 1.11 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.085 0.469 . . . . 74.019999999999996 110.337 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.09 113.09 1.86 Allowed 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.501 -0.772 . . . . 73.329999999999998 109.75 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.2 t -84.34 158.63 21.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.898 -0.592 . . . . 75.219999999999999 110.919 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -162.8 113.48 1.47 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.179 0.592 . . . . 53.420000000000002 109.903 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.94 104.18 0.48 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 62.229999999999997 110.487 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 50.2 pttt -80.24 119.84 23.53 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.104 -0.498 . . . . 51.039999999999999 110.74 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.1 m -90.66 124.05 43.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 116.35 -0.387 . . . . 53.530000000000001 110.728 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -156.82 118.93 3.89 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.108 0.48 . . . . 72.140000000000001 111.292 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.73 158.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.736 -0.665 . . . . 72.400000000000006 109.339 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.11 153.9 30.08 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 61.0 110.145 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.6 p -158.47 98.33 1.75 Allowed Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 116.28 -0.418 . . . . 60.420000000000002 111.094 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -80.82 157.36 21.08 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.593 2.196 . . . . 64.400000000000006 111.709 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.7 163.24 37.78 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 122.499 2.133 . . . . 72.239999999999995 111.854 179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.01 129.17 94.04 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.338 -0.392 . . . . 54.130000000000003 110.224 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.13 74.43 5.04 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.676 2.251 . . . . 75.120000000000005 112.564 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.5 m -85.81 125.84 40.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 116.148 -0.478 . . . . 51.310000000000002 110.506 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 18.5 p -90.42 146.79 23.88 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.145 -0.479 . . . . 70.549999999999997 110.914 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -68.45 137.85 54.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.493 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -90.91 162.27 28.67 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 111.035 -0.826 . . . . 72.430000000000007 111.035 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -165.84 92.14 0.51 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.843 0.354 . . . . 54.210000000000001 110.879 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.17 99.43 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.681 -0.489 . . . . 73.530000000000001 109.681 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.3 mtt -145.52 152.36 49.27 Favored Pre-proline 0 C--N 1.315 -0.899 0 N-CA-C 109.232 -0.655 . . . . 53.200000000000003 109.232 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.27 119.24 5.17 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 122.784 2.323 . . . . 73.120000000000005 111.637 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.5 m -82.34 149.14 27.9 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.876 -0.602 . . . . 74.140000000000001 110.429 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 46' ' ' SER . 6.4 tt -151.32 134.8 16.2 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.57 -0.9 . . . . 61.340000000000003 108.57 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 45' ' ' LEU . 22.4 m -71.63 89.11 0.98 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 53.030000000000001 111.242 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.2 p -101.65 -19.13 15.55 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.032 -0.531 . . . . 73.040000000000006 110.216 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.66 39.6 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.89 -0.596 . . . . 64.420000000000002 110.574 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -85.52 148.53 25.91 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.195 -0.457 . . . . 71.099999999999994 109.975 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -160.82 174.09 14.39 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.948 -0.389 . . . . 74.340000000000003 109.948 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -82.0 150.66 65.62 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 116.382 -0.372 . . . . 63.32 111.228 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 94.9 Cg_endo -81.19 166.68 18.32 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.571 2.18 . . . . 64.209999999999994 110.43 174.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.19 111.54 25.23 Favored Pre-proline 0 C--N 1.318 -0.788 0 CA-C-O 120.622 0.249 . . . . 74.5 110.401 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 97.8 Cg_endo -85.92 124.52 2.58 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.621 2.214 . . . . 75.319999999999993 111.509 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.1 m -80.59 153.34 4.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 120.859 -0.336 . . . . 54.310000000000002 111.167 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -167.15 173.61 8.94 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.365 -0.606 . . . . 75.329999999999998 109.365 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.7 m 70.93 112.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.767 0.667 . . . . 75.200000000000003 110.645 -178.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 115.96 38.5 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.899 -0.592 . . . . 63.420000000000002 111.238 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -85.19 -179.91 3.79 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.059 2.506 . . . . 73.040000000000006 111.737 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.2 m -78.85 -176.63 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.599 0 N-CA-C 109.811 -0.44 . . . . 73.150000000000006 109.811 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.438 HD23 HD11 ' A' ' 93' ' ' LEU . 28.5 tp -87.77 91.98 8.95 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.725 0.774 . . . . 75.430000000000007 110.705 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -132.22 75.38 1.63 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.163 -0.926 . . . . 62.439999999999998 109.369 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.1 156.54 78.18 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.249 -0.887 . . . . 75.310000000000002 109.51 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -51.11 116.34 2.6 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.952 2.435 . . . . 63.299999999999997 111.936 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 65' ' ' LEU . 2.6 pt? -70.1 134.31 48.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.116 0.484 . . . . 52.039999999999999 110.288 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.92 -39.92 2.61 Favored Glycine 0 N--CA 1.44 -1.038 0 N-CA-C 110.506 -1.038 . . . . 63.32 110.506 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 t -64.31 158.75 22.62 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.147 0.579 . . . . 72.310000000000002 110.683 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -68.65 -26.24 65.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.24 -0.436 . . . . 65.450000000000003 110.83 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -60.6 -43.47 97.39 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.043 0.449 . . . . 74.140000000000001 111.276 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -67.8 -39.22 84.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.884 -0.598 . . . . 73.209999999999994 110.211 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HB3' ' SD ' ' A' ' 133' ' ' MET . 49.0 mt-30 -64.33 -49.54 71.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.32 -0.4 . . . . 70.450000000000003 110.657 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.9 mm100 -54.68 -50.39 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 111.39 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.3 m -64.03 -38.99 93.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 110.13 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.594 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 63.1 t80 -54.43 -46.51 73.22 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.789 -0.641 . . . . 73.010000000000005 111.033 176.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 74.9 p -68.59 -35.33 77.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.84 -0.344 . . . . 74.540000000000006 111.302 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 18.4 mm-40 -55.96 -48.39 75.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.262 -0.426 . . . . 74.010000000000005 111.706 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.6 pt20 -59.02 -33.81 71.16 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.593 0.235 . . . . 70.439999999999998 111.13 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.96 -35.35 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 N-CA-C 109.777 -0.453 . . . . 64.409999999999997 109.777 -177.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.05 -36.04 82.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.889 -0.596 . . . . 74.030000000000001 109.437 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.552 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 40.8 tp -67.42 -47.91 68.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.863 -0.608 . . . . 64.420000000000002 109.876 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -55.62 -49.34 73.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.015 -0.539 . . . . 74.540000000000006 111.795 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.1 t -65.97 -26.68 67.68 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.979 -0.288 . . . . 74.530000000000001 111.123 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -69.98 -46.11 65.9 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.799 0.333 . . . . 75.430000000000007 110.407 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.552 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 44.3 mt-30 -74.45 -32.51 62.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.188 -0.46 . . . . 72.120000000000005 111.253 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.1 51.31 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.666 -0.778 . . . . 55.130000000000003 112.59 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.4 HE21 ' HB2' ' A' ' 86' ' ' GLN . 3.1 pt20 -83.59 117.33 23.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.904 0.383 . . . . 63.240000000000002 111.197 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 10.6 pt20 -78.03 -36.53 48.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.413 0.625 . . . . 64.439999999999998 110.092 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 p -95.35 133.92 38.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.315 -0.857 . . . . 72.109999999999999 110.736 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.18 145.01 23.55 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.072 0.463 . . . . 51.549999999999997 111.984 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -132.59 125.6 30.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 64.430000000000007 109.518 177.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.4 tp -125.94 159.58 32.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.154 -0.313 . . . . 63.439999999999998 110.154 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.32 122.87 26.89 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.07 -0.715 . . . . 75.519999999999996 109.07 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.438 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.1 166.09 23.86 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.033 0.753 . . . . 62.43 113.033 -174.224 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.683 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 48.9 p-80 -116.63 154.9 49.31 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.375 -1.284 . . . . 74.040000000000006 109.461 176.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.683 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 88.7 Cg_exo -48.27 128.33 0.51 Allowed 'Cis proline' 0 C--N 1.367 1.511 0 CA-C-N 119.659 0.914 . . . . 74.010000000000005 113.796 1.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -48.83 -38.78 23.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.753 -1.112 . . . . 64.420000000000002 112.557 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -47.79 -32.64 6.23 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.675 0.62 . . . . 72.120000000000005 112.675 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.38 -29.08 68.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.813 0.339 . . . . 73.549999999999997 110.72 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.48 -42.92 1.77 Allowed Glycine 0 N--CA 1.448 -0.543 0 CA-C-N 116.0 -0.545 . . . . 34.539999999999999 114.2 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -160.25 -174.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 117.304 0.552 . . . . 74.409999999999997 110.917 -176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 70.6 t -138.82 132.52 40.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 107.809 -1.182 . . . . 72.450000000000003 107.809 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.533 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 16.4 t60 -98.16 101.62 13.14 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.813 -0.44 . . . . 71.530000000000001 109.813 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.4 mp -99.92 116.28 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 74.299999999999997 111.119 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.4 m -120.44 86.16 2.52 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.974 -0.557 . . . . 53.43 110.327 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.743 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 52.7 tp -89.57 113.57 25.02 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 115.807 -0.633 . . . . 52.030000000000001 110.681 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -96.17 155.14 16.89 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.092 -0.707 . . . . 73.530000000000001 109.092 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -135.33 101.27 4.77 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.345 -0.542 . . . . 65.319999999999993 111.244 -173.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 110' ' ' ASN . 11.4 t70 -97.27 123.67 41.14 Favored 'General case' 0 C--O 1.21 -1.017 0 N-CA-C 107.699 -1.222 . . . . 74.349999999999994 107.699 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.4 t70 44.82 -82.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.67 0.619 . . . . 74.109999999999999 112.67 -172.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' ASP . 7.1 p30 -143.43 16.58 1.85 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.084 0.469 . . . . 72.219999999999999 110.134 178.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.531 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 30.2 pt20 -115.99 119.03 34.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.516 -0.92 . . . . 54.299999999999997 108.516 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -106.05 133.18 51.17 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 113.818 1.044 . . . . 74.209999999999994 113.818 -174.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HA ' ' HB2' ' A' ' 147' ' ' GLN . 5.1 tp-100 -95.91 108.47 20.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.925 -1.034 . . . . 63.140000000000001 108.887 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.9 tp -96.42 104.93 16.94 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 116.089 -0.505 . . . . 63.030000000000001 110.809 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -106.41 140.81 38.73 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.281 -0.418 . . . . 65.019999999999996 110.863 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.9 mtt -131.42 123.57 28.44 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.845 -0.616 . . . . 74.120000000000005 109.528 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.533 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 38.3 t -103.41 107.85 23.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.115 0.483 . . . . 61.409999999999997 109.783 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 18.1 p -163.76 143.36 6.5 Favored Pre-proline 0 C--N 1.311 -1.067 0 CA-C-N 115.141 -0.936 . . . . 74.209999999999994 109.881 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.33 147.71 21.0 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.689 2.259 . . . . 73.439999999999998 111.558 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -91.33 137.75 32.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.327 0.584 . . . . 63.130000000000003 111.447 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.4 t -158.68 179.99 8.6 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.561 -1.274 . . . . 52.299999999999997 107.561 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -62.98 -17.14 61.73 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.195 0.521 . . . . 75.239999999999995 110.175 179.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.32 -23.17 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.379 -0.828 . . . . 51.520000000000003 109.916 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 59.0 ttp180 -57.71 -33.51 68.49 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.666 -0.697 . . . . 72.239999999999995 110.176 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.09 83.48 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 74.150000000000006 110.956 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.47 75.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 52.109999999999999 110.67 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.2 -47.76 72.84 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.411 . . . . 64.129999999999995 110.531 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 48.2 mt-10 -62.71 -39.3 93.59 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.028 -0.533 . . . . 71.329999999999998 110.589 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.34 -31.97 69.66 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.193 0.442 . . . . 73.010000000000005 112.193 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.62 -16.62 57.14 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.136 0.421 . . . . 72.109999999999999 112.136 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.432 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 99.2 mt -61.33 -55.18 45.88 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 112.429 0.529 . . . . 74.530000000000001 112.429 -177.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.9 Cg_endo -60.48 -24.1 77.03 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.295 1.997 . . . . 72.409999999999997 111.943 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 71' ' ' GLN . 42.7 ttp -78.13 -42.76 30.88 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.608 0.718 . . . . 43.020000000000003 109.474 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 20.7 tp -67.54 -44.86 77.3 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.857 -1.065 . . . . 71.239999999999995 110.624 -176.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -66.98 -10.27 47.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.099 0.407 . . . . 70.540000000000006 112.099 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 86.1 m -88.07 -42.14 12.59 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.166 -0.679 . . . . 70.439999999999998 109.166 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -69.11 -43.96 73.4 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.771 -0.649 . . . . 72.239999999999995 110.81 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.28 -26.87 64.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 71.0 111.551 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.46 73.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.886 0.374 . . . . 75.450000000000003 110.524 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.93 -18.37 60.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.713 -0.676 . . . . 74.530000000000001 110.385 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.8 t -96.4 -11.92 25.02 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.869 -0.605 . . . . 45.399999999999999 110.216 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 96.11 38.57 4.54 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.811 -0.631 . . . . 64.230000000000004 112.269 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.0 mp -134.06 128.9 53.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.785 -0.45 . . . . 73.120000000000005 109.785 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -112.75 108.9 18.08 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.363 -0.606 . . . . 74.230000000000004 109.363 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.504 HD23 ' HB3' ' A' ' 112' ' ' ALA . 76.6 mt -66.94 -95.72 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.658 0.266 . . . . 72.25 111.675 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 75.82 -54.19 2.96 Favored Glycine 0 C--N 1.329 0.176 0 C-N-CA 120.918 -0.658 . . . . 71.519999999999996 111.543 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 113' ' ' GLN . 78.7 mt-30 -81.12 113.2 19.13 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.664 -0.495 . . . . 63.149999999999999 109.664 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 23.1 m -144.8 139.99 28.15 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.999 -0.371 . . . . 61.32 109.999 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.9 m -140.5 136.09 32.58 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.823 0.344 . . . . 73.420000000000002 110.82 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.6 mt -126.9 110.73 23.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 108.14 -1.059 . . . . 64.150000000000006 108.14 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 3.8 m -136.98 149.54 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 116.412 -0.358 . . . . 60.119999999999997 111.157 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 24.8 m -80.94 -27.05 36.23 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.735 -0.839 . . . . 74.140000000000001 108.735 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -40.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.107 -0.952 . . . . 72.109999999999999 110.777 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 62.1 p -162.17 -66.04 0.05 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.916 0.389 . . . . 75.409999999999997 110.303 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -141.52 142.01 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.538 -0.541 . . . . 73.310000000000002 109.538 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -145.34 139.62 27.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.852 0.358 . . . . 63.240000000000002 110.553 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 136.7 -124.98 3.3 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 110.868 -0.893 . . . . 64.450000000000003 110.868 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 69.01 -5.36 1.05 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.791 0.663 . . . . 62.229999999999997 112.791 176.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -81.16 130.68 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.732 0.301 . . . . 62.340000000000003 110.821 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . 0.453 ' HA ' ' OE1' ' A' ' 160' ' ' GLN . 5.5 tp60 -153.65 138.12 16.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.04 0.448 . . . . 73.219999999999999 111.071 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.4 t -144.73 161.97 37.89 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.807 -0.633 . . . . 54.009999999999998 109.648 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 49.3 m -162.29 113.54 1.6 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.166 -0.679 . . . . 74.340000000000003 109.166 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.2 p -142.45 142.6 32.35 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.242 -0.435 . . . . 65.230000000000004 110.495 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.3 148.94 16.92 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.56 -0.533 . . . . 75.510000000000005 109.56 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -160.8 116.61 2.24 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.629 -0.508 . . . . 74.420000000000002 109.629 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.59 -172.56 3.34 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.027 -0.533 . . . . 70.209999999999994 112.109 -178.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.4 m -159.52 173.92 15.43 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.148 -0.686 . . . . 73.409999999999997 109.148 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.9 m -156.01 147.79 23.02 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.082 -0.34 . . . . 24.109999999999999 110.082 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.556 -0.735 . . . . 74.319999999999993 110.199 179.264 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 110.124 -0.325 . . . . 73.310000000000002 110.124 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -77.23 160.41 28.94 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.863 -0.791 . . . . 74.140000000000001 108.863 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.13 -178.64 0.22 Allowed 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.705 0.628 . . . . 75.420000000000002 109.846 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.9 m -160.48 175.67 12.49 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 110.448 -0.205 . . . . 63.520000000000003 110.448 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -77.59 -21.08 52.95 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.025 -0.731 . . . . 72.450000000000003 109.025 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 65.15 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.717 -1.129 . . . . 63.409999999999997 113.838 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.84 167.49 10.25 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.19 -0.914 . . . . 74.439999999999998 111.038 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.64 152.37 17.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.173 -0.467 . . . . 73.299999999999997 110.039 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.13 126.2 10.58 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.415 -0.357 . . . . 72.319999999999993 110.211 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.96 -129.32 9.63 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.674 -0.774 . . . . 55.329999999999998 111.967 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.09 102.89 0.33 Allowed 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.813 2.342 . . . . 75.230000000000004 111.665 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 112.76 0.82 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.651 -0.704 . . . . 40.240000000000002 110.256 -178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.81 23.51 0.68 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.994 -0.548 . . . . 62.100000000000001 109.877 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 t -82.36 130.71 58.26 Favored Pre-proline 0 N--CA 1.438 -1.056 0 CA-C-N 116.028 -0.533 . . . . 52.32 110.219 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.66 -16.21 30.18 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.803 2.335 . . . . 70.530000000000001 111.766 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.8 mt -77.74 101.22 6.57 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.906 -0.588 . . . . 53.310000000000002 110.503 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.9 p -84.12 89.59 2.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-O 121.867 0.842 . . . . 75.140000000000001 109.588 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.6 p -155.88 154.79 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 115.437 -0.801 . . . . 74.129999999999995 110.728 -177.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.3 -36.88 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.111 -0.699 . . . . 75.310000000000002 109.111 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -163.13 0.17 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.237 -0.892 . . . . 74.420000000000002 110.522 175.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.09 -164.9 0.91 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.773 -0.454 . . . . 74.030000000000001 109.773 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.07 134.54 10.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.777 0.322 . . . . 72.219999999999999 110.184 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 t -157.15 164.7 37.53 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.859 -0.609 . . . . 73.209999999999994 109.974 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.2 p -169.17 115.22 0.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.396 -0.365 . . . . 74.430000000000007 110.735 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.91 85.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.346 -0.388 . . . . 73.099999999999994 111.387 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -163.47 154.71 16.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.419 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -150.92 92.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.724 0.773 . . . . 71.140000000000001 110.37 178.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -89.5 157.26 18.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.669 -0.696 . . . . 73.239999999999995 111.919 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 p -161.19 116.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.636 -0.711 . . . . 73.129999999999995 110.115 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.06 149.24 17.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.203 -0.453 . . . . 63.229999999999997 109.868 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 p -152.91 108.77 2.68 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-O 120.708 0.29 . . . . 72.0 110.975 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -74.84 147.82 35.21 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 122.508 2.139 . . . . 63.539999999999999 111.819 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.44 175.33 10.23 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.61 2.207 . . . . 74.019999999999996 111.877 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.99 117.8 57.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.304 -0.407 . . . . 34.039999999999999 111.454 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -82.59 62.94 7.99 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.894 2.396 . . . . 70.430000000000007 111.588 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.63 160.87 3.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.928 -0.578 . . . . 73.109999999999999 111.205 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.9 m -149.5 133.15 16.8 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.269 -0.423 . . . . 75.0 109.888 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -116.45 168.42 10.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 74.420000000000002 110.165 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 161.84 136.46 2.0 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.764 -0.732 . . . . 72.140000000000001 111.905 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.33 154.65 8.77 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.804 0.335 . . . . 62.509999999999998 111.39 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.83 145.39 2.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.643 -0.708 . . . . 60.399999999999999 109.436 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 70.8 mtm -148.39 116.18 3.97 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-O 120.769 0.318 . . . . 73.430000000000007 111.102 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.24 -174.92 2.45 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 122.766 2.311 . . . . 64.340000000000003 111.618 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 t -153.23 -179.08 7.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.082 -0.34 . . . . 62.130000000000003 110.082 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 46' ' ' SER . 3.1 tm? -154.96 137.17 14.81 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.831 -0.803 . . . . 43.009999999999998 108.831 -178.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.482 ' N ' HD13 ' A' ' 45' ' ' LEU . 17.4 t -161.57 113.28 1.76 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.685 -0.487 . . . . 74.530000000000001 109.685 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 t -118.89 144.29 46.49 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.095 -0.502 . . . . 72.430000000000007 110.706 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.77 28.52 0.22 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.447 -0.797 . . . . 41.409999999999997 109.199 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.3 m -146.69 164.36 32.94 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.458 -0.792 . . . . 53.100000000000001 108.968 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 75.17 12.59 3.33 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.385 0.674 . . . . 72.129999999999995 110.399 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -85.92 117.69 69.17 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.275 -0.875 . . . . 73.030000000000001 110.128 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 34.1 Cg_exo -60.42 132.63 44.59 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.404 2.069 . . . . 72.230000000000004 111.342 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.56 103.22 17.46 Favored Pre-proline 0 C--N 1.315 -0.9 0 N-CA-C 109.717 -0.475 . . . . 73.409999999999997 109.717 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' A' ' 52' ' ' PRO . 4.9 Cg_exo -77.39 178.67 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.729 2.286 . . . . 72.310000000000002 112.41 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.4 t 68.59 108.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 115.424 -0.807 . . . . 60.310000000000002 111.432 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -164.66 21.53 0.06 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.771 -0.65 . . . . 53.100000000000001 110.605 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.1 m -156.63 123.14 5.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.284 -0.416 . . . . 70.219999999999999 110.861 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.14 126.8 92.54 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 116.1 -0.5 . . . . 73.340000000000003 110.332 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.99 177.64 8.48 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.557 2.171 . . . . 63.32 111.744 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 m -84.69 172.06 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.472 -0.331 . . . . 65.140000000000001 110.198 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.5 tp -88.04 93.37 9.46 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.197 0.523 . . . . 72.409999999999997 110.546 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.2 m -131.0 82.86 2.07 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.732 -0.667 . . . . 73.310000000000002 110.588 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.39 165.61 35.07 Favored Pre-proline 0 C--N 1.314 -0.939 0 N-CA-C 108.88 -0.785 . . . . 52.350000000000001 108.88 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -53.26 128.67 30.11 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.23 1.953 . . . . 71.140000000000001 111.767 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.1 109.06 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.009 0.433 . . . . 73.200000000000003 110.706 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 118.98 -22.78 8.96 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.616 -0.72 . . . . 73.219999999999999 111.8 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -61.22 152.47 28.77 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 120.752 0.31 . . . . 41.350000000000001 111.142 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -64.66 -38.34 90.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.216 -0.447 . . . . 72.430000000000007 110.459 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -59.9 -40.01 87.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 111.023 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -64.99 -52.79 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.548 -0.296 . . . . 74.129999999999995 110.493 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -62.74 -41.29 99.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.601 -0.44 . . . . 75.209999999999994 111.696 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 56.2 mt-30 -60.86 -36.4 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.634 0.254 . . . . 72.5 111.665 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 35.8 m -71.06 -42.45 69.42 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.539 -0.541 . . . . 75.409999999999997 109.539 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.436 ' HZ ' ' SD ' ' A' ' 116' ' ' MET . 79.6 t80 -56.4 -46.85 79.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.337 -0.847 . . . . 73.030000000000001 111.069 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' MET . 57.3 p -64.3 -41.6 96.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.683 -0.407 . . . . 40.420000000000002 111.126 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 72' ' ' GLN . 45.3 mt-30 -55.27 -50.89 68.35 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.383 -0.371 . . . . 61.350000000000001 111.806 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -61.74 -32.1 72.32 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.554 -0.293 . . . . 44.149999999999999 111.562 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' PHE . 84.5 t -77.68 -38.38 25.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.921 0.391 . . . . 63.039999999999999 110.031 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.4 mtp -61.37 -40.91 96.04 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.268 -0.642 . . . . 63.149999999999999 109.268 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -56.59 -44.27 80.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.442 -0.799 . . . . 61.219999999999999 110.775 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -60.06 -47.98 83.62 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.397 -0.365 . . . . 54.200000000000003 111.959 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 t -71.85 -21.66 61.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.798 -0.361 . . . . 72.040000000000006 111.394 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 79' ' ' MET . 98.1 mtt180 -74.09 -33.15 63.52 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.135 0.493 . . . . 73.540000000000006 110.149 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -83.83 -168.3 2.08 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.571 -0.741 . . . . 53.450000000000003 110.368 177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.7 -5.05 57.83 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.4 -0.905 . . . . 74.430000000000007 112.642 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -81.77 178.92 8.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.668 0.27 . . . . 75.219999999999999 110.967 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -160.0 16.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.266 0.555 . . . . 74.439999999999998 110.639 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 p -153.46 145.53 23.72 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 109.025 -0.731 . . . . 74.439999999999998 109.025 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.59 159.02 32.73 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.043 0.449 . . . . 64.530000000000001 111.763 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.24 143.9 51.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.44 -0.8 . . . . 52.229999999999997 108.991 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 34.1 tp -145.36 158.58 43.8 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.758 -0.46 . . . . 74.430000000000007 109.758 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -79.61 117.96 21.01 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.315 0.579 . . . . 74.549999999999997 110.579 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 101' ' ' VAL . 3.7 mm? -130.78 145.4 51.95 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.256 -0.884 . . . . 52.219999999999999 111.461 -177.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.586 ' HA ' ' O ' ' A' ' 95' ' ' PRO . 25.9 p-80 -104.83 168.38 8.54 Favored Pre-proline 0 C--N 1.316 -0.885 0 N-CA-C 108.226 -1.027 . . . . 74.129999999999995 108.226 174.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.586 ' O ' ' HA ' ' A' ' 94' ' ' HIS . 10.4 Cg_endo -51.77 166.44 4.69 Favored 'Cis proline' 0 C--N 1.362 1.266 0 N-CA-C 115.605 1.348 . . . . 75.239999999999995 115.605 2.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.6 -41.39 81.12 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.964 -1.471 . . . . 73.230000000000004 109.843 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -44.76 -50.51 10.07 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.052 -0.976 . . . . 74.420000000000002 111.91 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.93 -44.1 93.87 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.241 0.46 . . . . 74.409999999999997 112.241 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.86 -43.82 0.38 Allowed Glycine 0 CA--C 1.533 1.189 0 N-CA-C 114.786 0.674 . . . . 40.399999999999999 114.786 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -157.6 174.51 15.25 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 117.272 0.536 . . . . 72.319999999999993 110.548 -177.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' A' ' 93' ' ' LEU . 79.3 t -142.22 138.11 29.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 74.420000000000002 109.274 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -103.0 105.15 15.41 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.831 -0.433 . . . . 63.240000000000002 109.831 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.9 mp -94.44 118.09 39.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-O 120.958 0.408 . . . . 75.099999999999994 110.794 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 19.7 m -103.53 170.6 7.84 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.649 -0.705 . . . . 62.130000000000003 109.479 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 tp -152.82 112.69 3.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.244 -0.28 . . . . 62.409999999999997 110.244 -175.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 97.5 mttt -104.99 141.89 35.76 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 120.789 -0.364 . . . . 75.439999999999998 110.453 177.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -132.65 115.28 15.21 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.75 -0.833 . . . . 70.319999999999993 108.75 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.33 142.58 27.28 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.797 -0.446 . . . . 72.340000000000003 109.797 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 15.4 t70 57.89 -97.32 0.07 Allowed 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.511 0.507 . . . . 71.109999999999999 110.611 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -144.85 27.29 1.33 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.866 0.841 . . . . 73.209999999999994 108.929 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.445 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 12.0 pt20 -133.67 144.59 49.27 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.244 -0.889 . . . . 72.010000000000005 110.168 -175.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -113.83 128.71 56.52 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.007 -0.542 . . . . 53.340000000000003 110.371 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.525 HE21 ' NE2' ' A' ' 147' ' ' GLN . 34.0 tt0 -102.12 115.25 30.16 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.709 -0.849 . . . . 63.450000000000003 108.709 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -92.39 107.37 19.16 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.911 -0.403 . . . . 44.039999999999999 109.911 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.532 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 27.5 mt-30 -99.38 138.25 36.74 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.653 -0.703 . . . . 72.099999999999994 110.733 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.436 ' SD ' ' HZ ' ' A' ' 74' ' ' PHE . 72.0 mtm -140.47 146.08 37.76 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.287 -0.634 . . . . 73.439999999999998 109.287 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 42.4 t -107.94 105.01 17.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 109.931 -0.396 . . . . 74.319999999999993 109.931 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -156.25 143.72 13.9 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-O 120.717 0.294 . . . . 75.450000000000003 110.474 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.15 177.37 4.5 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.739 2.959 . . . . 72.040000000000006 112.125 178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -85.47 113.07 21.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.506 -0.553 . . . . 74.530000000000001 109.506 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.9 t -150.72 164.69 35.53 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.17 -0.923 . . . . 71.239999999999995 109.268 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.07 -21.53 66.56 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.113 0.482 . . . . 72.209999999999994 110.157 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.76 -32.68 55.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.057 -0.519 . . . . 71.209999999999994 110.213 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -62.25 -26.09 68.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.77 -0.65 . . . . 73.219999999999999 110.717 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.84 97.65 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.012 -0.54 . . . . 22.440000000000001 109.889 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.02 79.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 73.310000000000002 111.019 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.5 -40.88 98.13 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.042 0.449 . . . . 74.310000000000002 110.261 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -72.29 -44.68 62.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.749 -0.66 . . . . 60.439999999999998 110.866 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -18.39 58.2 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.502 0.556 . . . . 74.340000000000003 112.502 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.26 -18.13 53.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.775 0.321 . . . . 52.450000000000003 111.419 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.505 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 64.0 mt -67.98 -50.84 30.42 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.956 0.724 . . . . 72.349999999999994 112.956 -175.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 11.1 Cg_endo -55.21 -28.92 64.18 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 122.477 2.118 . . . . 64.400000000000006 112.855 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 52.3 ttp -83.27 -37.03 24.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.301 0.572 . . . . 73.439999999999998 110.08 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.81 -42.1 91.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.379 -0.828 . . . . 71.530000000000001 110.832 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -55.55 -36.25 66.6 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 116.243 -0.435 . . . . 74.400000000000006 110.853 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.464 ' O ' ' HG3' ' A' ' 140' ' ' GLU . 25.6 m -64.31 -48.4 75.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.057 0.456 . . . . 64.430000000000007 110.708 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.25 -39.57 78.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.853 -0.612 . . . . 63.32 111.041 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 43.9 tp -66.57 -39.01 88.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.198 -0.456 . . . . 73.340000000000003 110.355 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.26 70.52 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.013 -0.539 . . . . 53.329999999999998 110.899 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 136' ' ' THR . 41.8 mt-10 -71.19 -14.19 62.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 72.209999999999994 110.324 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.8 t -99.91 2.19 43.48 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.667 -0.697 . . . . 64.409999999999997 109.83 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.04 -24.74 29.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.035 -0.602 . . . . 64.439999999999998 113.421 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 41.2 mt -86.23 148.42 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.073 0.464 . . . . 63.310000000000002 111.076 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 3.1 mp0 -113.3 118.74 35.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.35 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.4 tp -78.71 -92.97 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.829 -0.434 . . . . 70.209999999999994 109.829 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 70.19 -66.25 0.72 Allowed Glycine 0 C--N 1.335 0.503 0 C-N-CA 121.525 -0.369 . . . . 63.43 113.12 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.525 ' NE2' HE21 ' A' ' 113' ' ' GLN . 28.1 tt0 -87.4 138.93 31.05 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.085 0.469 . . . . 74.519999999999996 110.837 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 19.3 m -148.73 159.26 44.3 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.59 -0.522 . . . . 42.310000000000002 109.59 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 47.9 t -146.5 139.0 25.14 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.951 0.405 . . . . 73.430000000000007 110.691 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 53.6 mt -136.86 106.62 4.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.209 -1.034 . . . . 71.319999999999993 108.209 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.7 m -98.17 125.97 43.44 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 116.078 -0.51 . . . . 75.140000000000001 111.399 -176.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 49.3 m -85.08 77.22 10.13 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.062 -0.517 . . . . 51.420000000000002 109.69 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 64.85 85.57 0.14 Allowed 'General case' 0 C--O 1.236 0.388 0 CA-C-N 114.918 -1.037 . . . . 53.0 112.06 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.3 t 70.98 -81.96 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.043 -0.981 . . . . 64.530000000000001 112.572 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -127.79 151.36 49.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 70.420000000000002 111.381 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.9 80.94 0.71 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.866 -0.606 . . . . 64.409999999999997 110.326 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -150.11 165.22 29.79 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.513 -0.851 . . . . 45.0 112.674 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -154.11 145.6 23.14 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.302 0.641 . . . . 74.140000000000001 109.497 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -152.45 151.15 30.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.692 0.282 . . . . 72.519999999999996 110.246 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -148.57 -178.58 6.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.054 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.8 p -143.71 169.61 17.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.238 -0.437 . . . . 52.020000000000003 110.51 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 15.6 p -168.9 158.32 8.71 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.483 -0.326 . . . . 63.109999999999999 110.661 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 35.8 t -145.93 161.26 40.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.761 -0.459 . . . . 42.25 109.761 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -158.74 165.04 35.26 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.691 -0.485 . . . . 74.140000000000001 109.691 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -147.84 171.98 14.86 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.605 -0.517 . . . . 74.120000000000005 109.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -105.34 114.74 29.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.058 0.392 . . . . 41.340000000000003 112.058 -176.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -73.75 160.93 30.8 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.737 -0.665 . . . . 62.109999999999999 109.437 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 63.5 m -157.53 152.13 25.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.89 0.376 . . . . 52.200000000000003 110.965 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.375 -0.822 . . . . 50.210000000000001 110.067 179.504 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.3 p80 . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.202 -0.296 . . . . 73.439999999999998 110.202 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -103.47 165.31 11.11 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.594 -0.521 . . . . 72.329999999999998 109.594 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 119.21 0.29 Allowed 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.37 0.419 . . . . 54.420000000000002 110.434 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 p -77.6 78.35 4.11 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.204 -0.453 . . . . 71.340000000000003 111.409 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -82.65 -44.56 15.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.235 -0.438 . . . . 72.420000000000002 110.433 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 61.06 101.54 0.02 OUTLIER 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.356 -0.838 . . . . 75.540000000000006 112.313 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 162.23 8.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.683 -0.69 . . . . 72.0 110.505 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -159.32 146.15 16.82 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.651 0.263 . . . . 52.009999999999998 110.434 -177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 25.7 m -85.79 114.61 22.87 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.941 -0.572 . . . . 73.0 110.673 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.49 116.48 5.59 Favored Glycine 0 N--CA 1.438 -1.232 0 C-N-CA 120.796 -0.716 . . . . 51.229999999999997 111.374 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -61.06 145.11 99.4 Favored 'Trans proline' 0 C--O 1.239 0.55 0 C-N-CA 122.666 2.244 . . . . 74.329999999999998 112.074 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.45 156.21 16.01 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.827 -0.624 . . . . 52.200000000000003 109.709 -179.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.453 HD13 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -151.95 173.31 15.0 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.844 0.354 . . . . 71.140000000000001 111.519 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.0 m -82.74 119.59 74.79 Favored Pre-proline 0 N--CA 1.441 -0.885 0 N-CA-C 109.469 -0.567 . . . . 34.109999999999999 109.469 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.33 105.48 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.228 2.619 . . . . 72.5 113.102 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.535 HD23 ' H ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -83.29 -16.07 47.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.968 -0.56 . . . . 63.350000000000001 110.943 178.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.91 112.61 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.313 0.577 . . . . 72.5 110.153 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.5 t -90.03 141.26 14.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.724 -0.671 . . . . 64.329999999999998 111.059 -177.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.88 169.11 20.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.138 -0.483 . . . . 62.43 109.752 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.54 141.26 53.87 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.89 0.376 . . . . 54.340000000000003 111.088 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.97 -168.48 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.957 -0.565 . . . . 65.519999999999996 111.23 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.32 170.37 22.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.069 -0.514 . . . . 73.200000000000003 109.677 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 33.3 m -151.7 129.44 11.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.846 0.355 . . . . 65.519999999999996 110.714 -177.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.1 m -72.43 116.24 12.65 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.247 -0.433 . . . . 74.129999999999995 109.918 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.51 165.72 18.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.134 -0.484 . . . . 75.549999999999997 110.009 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -149.91 139.78 21.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.47 -0.332 . . . . 73.510000000000005 110.202 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 p -90.2 105.99 16.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.42 0.629 . . . . 73.219999999999999 109.318 175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -79.89 105.52 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.279 0.561 . . . . 72.430000000000007 111.644 -176.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.3 m -112.27 138.03 42.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.663 -0.698 . . . . 63.210000000000001 109.931 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.1 t70 70.97 136.71 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.235 0.614 . . . . 73.319999999999993 111.898 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.0 p -153.59 92.37 3.17 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.946 -0.57 . . . . 75.319999999999993 110.165 178.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -87.57 148.05 7.37 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.001 2.467 . . . . 64.099999999999994 112.831 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.22 144.84 42.53 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.306 2.004 . . . . 63.439999999999998 110.985 177.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -73.3 116.77 54.31 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.391 -0.368 . . . . 53.439999999999998 110.703 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 22.9 Cg_exo -65.33 122.94 10.79 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.519 2.146 . . . . 74.319999999999993 111.016 178.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -141.97 138.73 30.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 110.136 -0.32 . . . . 75.219999999999999 110.136 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.7 t -145.12 143.33 30.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.487 -0.324 . . . . 62.219999999999999 110.171 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -125.9 157.23 38.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.331 -0.395 . . . . 61.509999999999998 110.188 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.23 136.76 4.05 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.773 -0.727 . . . . 34.420000000000002 112.287 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.71 126.73 1.3 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.867 -0.42 . . . . 64.329999999999998 109.867 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.04 -51.07 35.09 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.46 -0.337 . . . . 75.140000000000001 110.204 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 47.9 ttm 62.2 92.47 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 115.548 -0.751 . . . . 73.120000000000005 111.636 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.46 139.06 12.64 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.351 2.034 . . . . 73.230000000000004 112.063 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.0 t -82.6 -26.22 32.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.931 -0.396 . . . . 61.240000000000002 109.931 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.8 mt 67.75 172.55 0.27 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.539 -0.755 . . . . 75.239999999999995 111.716 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 m -76.5 145.9 38.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.905 -0.589 . . . . 63.329999999999998 110.75 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -80.67 159.42 25.32 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.582 -0.525 . . . . 74.239999999999995 109.582 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -152.2 12.61 0.57 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 111.868 0.321 . . . . 50.210000000000001 111.868 -177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -82.94 97.89 8.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.261 0.553 . . . . 72.409999999999997 109.805 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.17 137.59 43.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.412 -0.813 . . . . 74.549999999999997 111.137 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 pt20 -87.15 118.59 70.2 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 116.169 -0.469 . . . . 71.200000000000003 110.689 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.43 166.24 9.85 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.935 2.423 . . . . 62.420000000000002 112.308 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.56 118.43 70.01 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.192 -0.458 . . . . 73.049999999999997 110.481 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.3 116.15 3.43 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.808 2.338 . . . . 34.149999999999999 112.066 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.6 m -83.63 140.32 16.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 116.139 -0.482 . . . . 75.150000000000006 110.971 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.48 -30.66 66.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.057 -0.519 . . . . 72.340000000000003 110.444 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.8 m -157.2 148.52 21.98 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.856 -0.611 . . . . 64.120000000000005 110.03 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 147.91 97.58 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.207 -0.451 . . . . 52.219999999999999 111.021 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.22 148.14 34.05 Favored 'Trans proline' 0 C--O 1.24 0.588 0 C-N-CA 122.724 2.282 . . . . 70.299999999999997 112.567 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.24 170.54 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.087 -0.708 . . . . 62.450000000000003 109.087 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' A' ' 70' ' ' TRP . 8.3 tt -96.59 113.43 25.0 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.153 0.501 . . . . 72.409999999999997 111.63 -178.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.4 m -133.73 75.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.803 -0.635 . . . . 74.340000000000003 109.578 176.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.96 151.91 74.71 Favored Pre-proline 0 C--N 1.315 -0.907 0 CA-C-N 115.369 -0.832 . . . . 61.210000000000001 109.872 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 7.5 Cg_endo -50.6 124.78 14.06 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.983 2.456 . . . . 61.350000000000001 111.835 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 123' ' ' VAL . 0.5 OUTLIER -69.28 121.73 17.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.019 -0.537 . . . . 72.540000000000006 110.633 -175.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.28 -26.71 23.28 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.895 -0.593 . . . . 74.420000000000002 112.008 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 46.0 t -61.59 156.23 20.31 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.036 0.446 . . . . 43.5 111.733 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -65.64 -33.38 75.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.974 -0.75 . . . . 75.310000000000002 108.974 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -60.65 -38.29 84.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.48 -0.782 . . . . 74.109999999999999 110.562 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.548 ' CD1' HD21 ' A' ' 61' ' ' LEU . 87.6 t90 -63.19 -53.13 57.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.199 -0.455 . . . . 73.010000000000005 110.664 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.65 -40.79 80.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 74.030000000000001 110.942 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.91 -42.71 94.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.437 -0.347 . . . . 75.329999999999998 111.493 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 89.4 m -65.92 -47.5 74.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.048 0.451 . . . . 71.219999999999999 110.249 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.496 ' O ' HG23 ' A' ' 78' ' ' VAL . 89.8 t80 -54.51 -38.73 66.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.708 -0.678 . . . . 74.120000000000005 111.862 178.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.7 p -77.9 -40.11 40.87 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.385 0.513 . . . . 34.32 112.385 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 73' ' ' THR . 5.0 pp0? -62.1 -38.89 90.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 120.855 -0.338 . . . . 71.099999999999994 111.708 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -64.91 -24.16 67.44 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.968 0.413 . . . . 74.349999999999994 110.824 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 74' ' ' PHE . 76.2 t -81.51 -27.75 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 N-CA-C 109.905 -0.406 . . . . 74.200000000000003 109.905 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.2 mtp -58.91 -54.9 41.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 109.931 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.22 -38.73 92.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.223 -0.444 . . . . 52.240000000000002 110.696 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -56.09 -52.42 64.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.962 -0.563 . . . . 74.010000000000005 111.626 176.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.7 t -70.54 -22.68 62.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.229 -0.441 . . . . 74.409999999999997 111.459 -178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -71.7 -34.19 69.42 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.16 0.505 . . . . 75.030000000000001 110.006 176.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -82.26 -178.88 7.21 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.68 -0.691 . . . . 74.239999999999995 110.565 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.93 28.24 10.94 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.838 -0.696 . . . . 63.539999999999999 112.077 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -83.32 165.96 18.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.882 0.373 . . . . 61.030000000000001 111.136 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -157.55 -13.13 0.08 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.671 -0.695 . . . . 75.340000000000003 111.004 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.593 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 45.1 m -142.49 133.36 25.62 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.916 -0.401 . . . . 74.420000000000002 109.916 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.84 160.88 38.19 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.895 -0.593 . . . . 73.319999999999993 111.058 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 2.3 mp0 -109.96 119.41 39.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.608 -0.724 . . . . 64.510000000000005 109.205 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 tp -111.89 128.46 56.15 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 120.872 -0.331 . . . . 61.210000000000001 110.287 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -81.31 106.21 13.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.927 0.394 . . . . 75.239999999999995 110.404 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.541 HD12 HG21 ' A' ' 101' ' ' VAL . 22.6 mt -98.89 160.28 14.37 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.642 -0.708 . . . . 74.030000000000001 111.737 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.504 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.4 m170 -101.16 149.6 36.41 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 115.027 -0.988 . . . . 70.129999999999995 110.722 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.504 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 7.5 Cg_exo -70.26 152.48 93.61 Favored 'Cis proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.063 -1.64 . . . . 72.409999999999997 113.235 1.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -39.74 -37.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.182 -1.372 . . . . 54.450000000000003 112.861 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 12.7 pt-20 -43.33 -34.19 1.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.364 0.876 . . . . 64.310000000000002 113.364 177.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 HD22 ' HG2' ' A' ' 119' ' ' PRO . 70.7 mt -60.89 -31.43 70.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.561 0.22 . . . . 74.310000000000002 111.345 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.34 -46.13 0.19 Allowed Glycine 0 CA--C 1.528 0.871 0 N-CA-C 115.81 1.084 . . . . 73.329999999999998 115.81 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -156.84 167.04 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.749 0.775 . . . . 73.329999999999998 111.818 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.541 HG21 HD12 ' A' ' 93' ' ' LEU . 75.2 t -145.89 134.44 16.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 107.606 -1.257 . . . . 64.25 107.606 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -100.9 112.03 24.37 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.907 -0.717 . . . . 73.540000000000006 110.284 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' A' ' 88' ' ' SER . 61.0 mt -94.9 104.86 16.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.94 -0.573 . . . . 75.439999999999998 109.662 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.549 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.5 m -106.55 88.95 2.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.005 0.431 . . . . 54.109999999999999 110.561 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.623 HD11 ' HB1' ' A' ' 112' ' ' ALA . 57.8 tp -87.62 114.33 24.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.58 0.705 . . . . 64.030000000000001 112.448 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -94.48 153.14 18.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.908 -1.042 . . . . 63.25 109.637 175.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 50.5 tp -133.84 132.57 40.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.685 0.278 . . . . 61.420000000000002 110.68 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -149.33 139.76 22.42 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.494 -0.558 . . . . 55.009999999999998 109.494 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.9 t0 52.15 -88.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.989 0.516 . . . . 51.539999999999999 112.006 -178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.04 29.07 0.51 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.786 0.803 . . . . 74.450000000000003 109.361 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.516 ' HB3' HE21 ' A' ' 144' ' ' GLN . 4.0 pp0? -133.23 144.35 49.72 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.903 -1.044 . . . . 73.049999999999997 108.419 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.623 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -126.45 136.2 52.34 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 120.576 -0.449 . . . . 54.149999999999999 111.939 -177.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 28.5 tt0 -96.6 118.97 34.2 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.617 -0.72 . . . . 75.129999999999995 110.086 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 145' ' ' LEU . 0.5 OUTLIER -93.64 106.97 18.9 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.899 -0.591 . . . . 72.019999999999996 109.415 -179.397 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 28.2 mt-30 -96.4 133.24 41.06 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.365 -0.38 . . . . 74.430000000000007 110.241 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 61.5 mtt -123.1 115.51 21.94 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.259 -0.428 . . . . 63.32 110.328 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 95.5 t -112.28 120.46 62.58 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 109.678 -0.49 . . . . 64.319999999999993 109.678 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.7 p -162.43 161.97 19.77 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 53.340000000000003 109.448 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.468 ' HA ' ' HB2' ' A' ' 153' ' ' GLU . 9.4 Cg_endo -51.51 170.37 0.19 Allowed 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 123.174 2.583 . . . . 75.140000000000001 112.143 177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -94.81 134.85 36.98 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.19 -0.604 . . . . 72.200000000000003 110.682 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.0 t -170.23 169.05 7.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.786 -0.643 . . . . 72.140000000000001 109.454 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -70.24 -17.77 63.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.904 0.383 . . . . 72.010000000000005 110.352 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.469 HG13 HD21 ' A' ' 65' ' ' LEU . 59.8 t -61.22 -30.27 47.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.68 -0.691 . . . . 73.299999999999997 109.176 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.81 -36.12 80.21 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.33 -0.85 . . . . 71.319999999999993 109.8 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.72 -33.82 74.58 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.094 -0.503 . . . . 73.319999999999993 110.034 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.28 -38.59 85.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.804 -0.635 . . . . 62.409999999999997 110.687 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.3 mm? -63.12 -38.97 93.31 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.693 -0.484 . . . . 65.409999999999997 109.693 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.92 -46.07 88.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.49 -0.777 . . . . 61.409999999999997 110.328 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.87 -31.0 70.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.916 -0.583 . . . . 73.340000000000003 111.818 178.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.71 -17.36 59.96 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.212 0.449 . . . . 75.239999999999995 112.212 -178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 70.3 mt -60.96 -54.49 53.81 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.734 0.642 . . . . 65.409999999999997 112.734 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 23.6 Cg_exo -65.39 -24.76 56.87 Favored 'Trans proline' 0 C--N 1.369 1.656 0 C-N-CA 121.867 1.711 . . . . 73.239999999999995 111.742 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -77.19 -45.94 24.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.889 -0.596 . . . . 74.329999999999998 109.474 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.1 tp -68.3 -40.83 81.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.312 -0.858 . . . . 75.409999999999997 110.996 -178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 3.4 ppt_? -58.79 -30.82 67.87 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.598 -0.274 . . . . 72.120000000000005 110.542 178.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 48.0 m -71.36 -41.21 70.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.461 -0.336 . . . . 73.140000000000001 110.714 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -64.52 -42.58 95.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.946 0.403 . . . . 61.450000000000003 110.931 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.4 HD12 HD22 ' A' ' 145' ' ' LEU . 45.9 mt -78.5 -25.33 45.62 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.395 -0.366 . . . . 63.25 110.998 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.24 -34.04 74.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 65.299999999999997 110.756 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -75.69 -16.02 60.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 54.130000000000003 111.141 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 -14.05 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.167 -0.47 . . . . 45.119999999999997 110.847 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.2 19.79 11.18 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.33 -0.938 . . . . 70.0 112.523 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.49 122.3 64.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.781 -0.822 . . . . 61.049999999999997 108.781 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.516 HE21 ' HB3' ' A' ' 111' ' ' GLN . 18.4 mt-30 -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 119.959 -0.696 . . . . 74.450000000000003 110.186 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 114' ' ' LEU . 11.7 tp -92.77 31.73 1.34 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.144 0.497 . . . . 72.019999999999996 109.803 177.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.61 -17.96 71.47 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.094 -0.574 . . . . 54.439999999999998 112.515 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 57.5 tt0 -101.0 128.96 46.79 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.771 -0.455 . . . . 75.439999999999998 109.771 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.1 t -152.46 156.89 40.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 120.732 0.301 . . . . 75.209999999999994 110.433 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 16.9 m -145.04 136.27 25.0 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.526 -0.546 . . . . 73.219999999999999 109.526 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 57.8 mt -127.58 117.07 45.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.89 -0.411 . . . . 64.400000000000006 109.89 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 17.5 m -103.3 125.02 49.72 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.436 -0.347 . . . . 73.019999999999996 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 18.5 m -82.09 65.02 7.03 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.33 -0.395 . . . . 74.099999999999994 110.187 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 119' ' ' PRO . 30.9 tt0 72.79 132.12 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.364 1.065 . . . . 61.399999999999999 111.121 -179.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 31.4 m -76.73 101.42 5.79 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.953 -0.567 . . . . 61.43 110.687 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -83.7 139.87 32.49 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.396 . . . . 62.539999999999999 110.172 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.26 89.36 6.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.057 0.456 . . . . 52.200000000000003 110.355 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -80.95 164.22 46.24 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.916 -0.659 . . . . 62.119999999999997 112.25 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -159.55 23.08 0.19 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.4 0.619 . . . . 75.530000000000001 109.846 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -75.5 101.43 4.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.857 -0.611 . . . . 74.049999999999997 110.695 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -153.57 111.98 3.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.28 -0.418 . . . . 71.439999999999998 110.466 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 49.1 m -148.5 177.53 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.245 -0.434 . . . . 73.230000000000004 110.164 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 58.6 m -163.82 134.64 4.47 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 122.826 0.45 . . . . 74.219999999999999 109.968 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 m -123.61 121.16 34.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.589 -0.278 . . . . 30.550000000000001 111.18 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 53.23 90.27 0.03 OUTLIER 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.656 0.783 . . . . 75.430000000000007 112.794 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -82.87 168.0 17.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.833 -0.621 . . . . 51.219999999999999 110.072 177.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.94 134.63 52.38 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.592 -0.521 . . . . 64.409999999999997 109.592 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 p -167.63 179.56 4.8 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.271 -0.422 . . . . 72.120000000000005 110.451 -177.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 p -159.37 178.12 10.27 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.1 -0.333 . . . . 72.129999999999995 110.1 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.585 -0.722 . . . . 75.129999999999995 110.238 179.769 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 110.314 -0.254 . . . . 72.310000000000002 110.314 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 mpt? 69.52 155.32 0.13 Allowed 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.753 0.658 . . . . 72.340000000000003 112.191 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.37 153.52 3.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.71 -0.677 . . . . 74.109999999999999 110.017 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 p -76.61 117.53 18.34 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.539 -0.301 . . . . 43.310000000000002 111.279 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -81.35 -25.97 35.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.791 0.329 . . . . 74.239999999999995 110.223 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.9 t70 68.82 118.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.466 -0.788 . . . . 51.399999999999999 112.251 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -94.49 129.21 41.35 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.09 -0.504 . . . . 64.25 109.948 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.36 81.25 0.53 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.047 -0.524 . . . . 42.200000000000003 110.246 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.4 p -97.11 164.9 12.31 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.726 -0.67 . . . . 54.219999999999999 111.019 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.11 75.48 0.72 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 44.409999999999997 112.361 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.78 155.92 61.65 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.511 2.141 . . . . 65.430000000000007 111.672 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.36 112.81 12.04 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.189 -0.46 . . . . 75.25 110.971 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.09 150.02 25.83 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 110.12 -0.326 . . . . 70.530000000000001 110.12 177.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 p -87.56 155.19 53.86 Favored Pre-proline 0 C--N 1.31 -1.151 0 CA-C-N 116.223 -0.444 . . . . 54.140000000000001 109.914 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -58.14 119.58 6.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 C-N-CA 122.445 2.097 . . . . 41.240000000000002 111.294 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.6 pt? -71.57 145.65 48.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.339 -0.392 . . . . 74.420000000000002 110.613 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -83.63 156.15 3.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 64.129999999999995 110.745 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.7 p -152.32 143.25 15.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 116.016 -0.538 . . . . 53.329999999999998 110.309 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 179.91 6.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.035 -0.529 . . . . 75.230000000000004 109.992 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.54 173.67 7.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.279 -0.419 . . . . 51.130000000000003 110.462 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -167.21 -176.8 3.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 65.209999999999994 109.19 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.22 -178.86 5.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.933 0.397 . . . . 55.020000000000003 111.031 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -144.53 151.24 38.83 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.728 -0.669 . . . . 61.140000000000001 109.724 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 p -163.72 115.23 1.39 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 61.350000000000001 111.075 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.21 163.84 7.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.392 -0.822 . . . . 53.520000000000003 108.967 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -156.88 84.1 0.95 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.908 0.385 . . . . 70.129999999999995 110.884 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.42 159.67 2.86 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 108.55 -0.908 . . . . 61.219999999999999 108.55 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -153.03 115.3 4.4 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 119.415 -0.914 . . . . 63.219999999999999 112.505 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -151.66 97.74 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 114.951 -1.022 . . . . 62.210000000000001 109.281 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -148.76 133.06 17.47 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.771 -0.65 . . . . 73.109999999999999 109.922 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.1 p -157.05 137.19 8.82 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 116.009 -0.541 . . . . 61.130000000000003 110.31 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.91 123.75 13.9 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.553 2.168 . . . . 54.399999999999999 111.578 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.74 118.87 4.86 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.029 2.486 . . . . 54.399999999999999 112.161 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.34 129.74 88.58 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.769 -0.651 . . . . 61.539999999999999 110.844 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 179.58 4.68 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.597 2.198 . . . . 74.239999999999995 112.196 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.53 114.26 22.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.49 0.662 . . . . 72.129999999999995 110.815 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 15.2 t -89.78 -19.93 24.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.972 -0.558 . . . . 43.520000000000003 110.33 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -71.55 128.82 37.09 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.205 -0.452 . . . . 73.150000000000006 110.046 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.07 -171.79 43.33 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.712 -0.756 . . . . 71.109999999999999 112.882 -178.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.62 -168.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.489 -0.56 . . . . 64.409999999999997 109.489 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.76 -169.19 2.0 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.104 -0.332 . . . . 74.439999999999998 110.104 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.1 tpt -139.09 102.16 7.55 Favored Pre-proline 0 C--N 1.317 -0.839 0 CA-C-O 120.824 0.345 . . . . 74.120000000000005 110.822 -178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.53 111.07 3.23 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.759 2.306 . . . . 74.540000000000006 111.061 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.8 t -151.28 152.7 33.59 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.287 -0.415 . . . . 72.329999999999998 110.22 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 tp -159.68 166.24 30.99 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.743 -0.836 . . . . 73.329999999999998 108.743 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.7 m -157.89 88.36 0.97 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 71.129999999999995 110.119 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 p -113.04 152.15 29.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.625 -0.716 . . . . 74.420000000000002 110.02 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -157.22 92.32 1.24 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.441 0.638 . . . . 64.129999999999995 110.383 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.2 m -151.47 98.43 2.51 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.581 -0.736 . . . . 62.350000000000001 110.227 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.2 174.65 9.18 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.707 -0.679 . . . . 62.119999999999997 110.088 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -77.81 114.82 44.91 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 109.946 -0.391 . . . . 64.019999999999996 109.946 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.36 106.0 0.79 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.539 2.159 . . . . 75.400000000000006 111.229 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.3 mt -114.34 105.53 53.78 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.254 -0.43 . . . . 71.420000000000002 110.639 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.72 146.94 27.21 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.421 2.08 . . . . 71.420000000000002 111.216 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.5 m -80.36 81.97 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.783 0.801 . . . . 75.409999999999997 110.573 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.92 165.41 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.155 -0.929 . . . . 22.129999999999999 109.583 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.6 m -75.9 165.31 25.18 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.354 -0.384 . . . . 71.219999999999999 110.574 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.59 133.62 94.26 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.165 -0.47 . . . . 74.340000000000003 110.88 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -84.64 164.07 12.31 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.711 2.274 . . . . 74.239999999999995 111.898 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 m -91.41 164.75 2.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.506 -0.553 . . . . 44.119999999999997 109.506 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.4 tp -89.83 85.97 6.53 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.687 -0.805 . . . . 73.420000000000002 110.999 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m -136.28 75.13 1.53 Allowed 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.102 -0.954 . . . . 65.040000000000006 109.415 176.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -126.62 158.06 68.97 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.736 -0.665 . . . . 74.140000000000001 109.902 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -46.39 132.42 15.66 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.23 2.62 . . . . 63.039999999999999 112.099 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.6 tp -70.3 129.54 39.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 72.439999999999998 110.369 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 98.94 -26.23 25.05 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 120.832 -0.699 . . . . 61.5 111.558 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 t -60.11 142.22 54.55 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 121.008 0.432 . . . . 54.240000000000002 110.82 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 50.6 m80 -68.5 -25.06 64.77 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.979 -0.555 . . . . 70.0 109.557 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -68.19 -23.99 64.9 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.715 -0.675 . . . . 74.319999999999993 109.878 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -78.71 -50.0 12.14 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.968 -0.753 . . . . 72.319999999999993 108.968 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.422 HE21 ' HB2' ' A' ' 130' ' ' ALA . 42.3 mt-30 -59.08 -35.69 73.82 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.503 -0.771 . . . . 62.549999999999997 111.143 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' HIS . 52.8 mt-30 -73.76 -37.8 64.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.416 -0.356 . . . . 74.120000000000005 111.303 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 84.4 m -65.81 -36.46 83.57 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.016 0.436 . . . . 71.109999999999999 109.974 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 78' ' ' VAL . 72.0 t80 -64.16 -41.2 97.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.135 -0.691 . . . . 64.209999999999994 109.135 176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' MET . 39.4 m -57.05 -41.08 78.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.497 -0.774 . . . . 75.129999999999995 110.849 176.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 82.4 mm-40 -62.99 -54.4 38.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.407 -0.361 . . . . 64.140000000000001 111.208 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.05 -26.3 66.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.89 -0.595 . . . . 71.519999999999996 112.359 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 74' ' ' PHE . 99.3 t -83.81 -39.3 14.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.94 -0.304 . . . . 64.340000000000003 110.879 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.477 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 89.6 mtp -62.93 -27.69 69.55 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.487 -0.485 . . . . 55.229999999999997 109.883 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 58.3 tp -54.79 -29.52 54.52 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.499 -0.773 . . . . 71.519999999999996 111.477 176.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 86' ' ' GLN . 40.7 m-85 -59.85 -53.64 55.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.939 0.4 . . . . 72.140000000000001 111.484 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -77.87 -7.04 56.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 40.450000000000003 111.804 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HD3' ' HA ' ' A' ' 80' ' ' LEU . 78.9 mtp180 -72.67 -19.58 61.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.043 0.386 . . . . 71.409999999999997 112.043 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.2 31.96 0.17 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.829 1.048 . . . . 71.200000000000003 113.829 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.29 25.96 74.9 Favored Glycine 0 N--CA 1.463 0.5 0 C-N-CA 120.714 -0.755 . . . . 71.439999999999998 114.224 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' PHE . 30.0 tt0 -86.67 141.95 28.57 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.713 -0.477 . . . . 75.040000000000006 109.713 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -140.85 31.57 1.81 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.557 0.694 . . . . 71.299999999999997 110.442 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.6 m -151.32 150.41 30.48 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.322 -0.992 . . . . 63.130000000000003 108.322 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.72 118.39 2.14 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.842 0.682 . . . . 72.150000000000006 112.842 -177.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -108.35 114.11 27.71 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.679 -1.23 . . . . 42.420000000000002 107.679 173.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 29.0 tp -134.24 156.86 47.65 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 120.628 -0.429 . . . . 63.439999999999998 110.915 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 2.4 tmt_? -74.24 128.5 35.71 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.156 -1.053 . . . . 73.200000000000003 108.156 178.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.98 164.61 31.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.85 -0.614 . . . . 61.450000000000003 110.683 -172.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 15.6 p-80 -102.38 156.89 34.69 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.479 -0.934 . . . . 64.25 108.479 175.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.513 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 32.3 Cg_exo -61.61 158.01 55.19 Favored 'Cis proline' 0 N--CA 1.48 0.734 0 C-N-CA 124.787 -0.922 . . . . 62.329999999999998 113.239 0.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -71.56 -21.09 61.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 75.5 111.896 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.513 ' HG2' ' HB2' ' A' ' 95' ' ' PRO . 5.6 pt-20 -53.64 -41.99 67.35 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.757 0.313 . . . . 64.019999999999996 110.162 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.448 HD12 ' HG3' ' A' ' 97' ' ' GLU . 9.2 mp -75.21 -73.48 0.25 Allowed 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.212 -1.033 . . . . 71.0 108.212 172.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 104.18 -25.54 25.83 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.671 -1.149 . . . . 52.030000000000001 111.257 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -150.23 146.97 27.14 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 120.893 0.378 . . . . 73.209999999999994 111.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 51.0 t -132.29 130.38 60.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.597 -0.729 . . . . 70.409999999999997 109.316 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -96.51 111.39 23.52 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.222 -0.288 . . . . 75.409999999999997 110.222 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 104' ' ' SER . 53.8 mt -85.75 161.97 2.92 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-O 121.244 0.545 . . . . 71.540000000000006 110.412 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 63.0 m -141.87 135.72 29.81 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.329 -0.85 . . . . 64.099999999999994 109.575 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.439 HD11 ' HB1' ' A' ' 112' ' ' ALA . 45.4 tp -129.01 143.14 50.77 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.985 0.422 . . . . 75.129999999999995 110.91 -177.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 80.0 tttt -128.92 115.43 17.83 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.525 -1.287 . . . . 74.439999999999998 107.525 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.464 HD11 HD13 ' A' ' 143' ' ' ILE . 4.7 tt -122.75 125.8 46.24 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.839 0.352 . . . . 74.439999999999998 111.063 -172.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 111' ' ' GLN . 26.4 m-20 -146.14 139.94 26.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.959 -0.564 . . . . 40.32 109.843 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 55.25 -91.74 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.272 0.629 . . . . 74.530000000000001 112.127 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -147.17 28.98 0.98 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.79 0.805 . . . . 73.120000000000005 108.844 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 0.3 OUTLIER -138.5 144.44 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.443 -1.253 . . . . 73.409999999999997 110.203 -177.356 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -137.9 137.42 38.02 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.041 -0.527 . . . . 65.209999999999994 110.937 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -101.36 129.46 47.37 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.12 -0.491 . . . . 75.510000000000005 109.746 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.0 mt -94.82 112.96 24.66 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.802 0.334 . . . . 73.25 111.214 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.554 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 45.3 mt-30 -95.62 146.13 24.71 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.307 -0.997 . . . . 72.299999999999997 108.307 174.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 49.9 mtm -145.99 146.6 31.06 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.621 0.6 . . . . 74.430000000000007 112.621 -173.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 86.8 t -133.53 119.97 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 107.616 -1.253 . . . . 65.409999999999997 107.616 176.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 152' ' ' SER . 4.8 m -161.6 160.5 23.05 Favored Pre-proline 0 C--N 1.312 -1.047 0 N-CA-C 109.167 -0.679 . . . . 65.540000000000006 109.167 -175.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -59.88 166.54 8.39 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 122.025 1.817 . . . . 75.019999999999996 111.242 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -100.61 111.62 23.89 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.3 -0.63 . . . . 74.230000000000004 109.3 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.425 ' OG ' HG22 ' A' ' 123' ' ' VAL . 60.2 p -168.32 -174.65 2.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.238 -0.437 . . . . 74.409999999999997 109.883 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -71.66 -8.32 53.38 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.432 0.53 . . . . 74.239999999999995 112.432 -176.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.425 HG22 ' OG ' ' A' ' 121' ' ' SER . 32.6 m -64.81 -13.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 121.775 0.798 . . . . 70.230000000000004 110.045 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.526 ' HD3' HG21 ' A' ' 150' ' ' ILE . 6.0 tpm_? -69.24 -34.99 75.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 114.525 -1.216 . . . . 72.409999999999997 109.289 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.31 75.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.211 -0.904 . . . . 40.119999999999997 111.416 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.2 -34.48 74.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 55.509999999999998 110.461 -178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.9 -43.86 64.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.9 -0.778 . . . . 75.209999999999994 108.9 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -60.46 -40.35 90.9 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.855 -0.611 . . . . 75.340000000000003 110.304 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.622 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -64.35 -35.86 82.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.708 -0.678 . . . . 65.329999999999998 111.73 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.422 ' HB2' HE21 ' A' ' 71' ' ' GLN . . . -74.04 -18.37 60.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.587 0.588 . . . . 73.400000000000006 112.587 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 97.7 mt -55.31 -51.04 83.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.159 0.8 . . . . 75.109999999999999 113.159 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.622 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.1 Cg_exo -56.53 -30.98 84.86 Favored 'Trans proline' 0 C--N 1.372 1.808 0 C-N-CA 122.267 1.978 . . . . 54.32 112.352 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 56.8 ttp -77.99 -46.77 20.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.575 0.702 . . . . 63.43 109.788 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 63.6 tp -55.75 -44.51 77.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.803 -1.09 . . . . 75.420000000000002 111.845 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -66.94 -19.44 65.72 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.417 -0.356 . . . . 61.539999999999999 111.745 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 24.3 m -68.88 -47.98 64.53 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.916 0.389 . . . . 71.129999999999995 110.054 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -69.9 -29.42 66.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 74.019999999999996 111.204 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.613 -0.514 . . . . 72.219999999999999 109.613 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.51 66.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.476 -0.784 . . . . 73.420000000000002 111.075 177.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -74.34 -15.04 60.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.231 0.539 . . . . 75.439999999999998 110.087 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.1 m -101.89 -2.93 28.8 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.576 -0.738 . . . . 74.409999999999997 110.016 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 97.92 -10.26 64.05 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.019 -0.61 . . . . 51.32 113.415 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.464 HD13 HD11 ' A' ' 107' ' ' LEU . 39.0 mt -100.0 116.02 42.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.916 0.358 . . . . 74.150000000000006 110.768 -179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -118.15 96.91 5.53 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.674 -0.41 . . . . 72.140000000000001 111.424 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.8 mt -29.82 142.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.587 1.155 . . . . 64.150000000000006 113.982 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -136.22 -60.21 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.373 -0.831 . . . . 73.409999999999997 111.258 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -91.16 170.34 10.09 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.977 -0.379 . . . . 75.430000000000007 109.977 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.5 m -158.88 166.44 31.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.671 0.272 . . . . 64.230000000000004 110.291 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.436 ' HB2' ' HA ' ' A' ' 115' ' ' GLN . 68.0 m -149.6 143.19 25.4 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.529 -0.545 . . . . 73.340000000000003 109.529 176.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.526 HG21 ' HD3' ' A' ' 124' ' ' ARG . 60.6 mt -138.72 131.31 38.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 109.553 -0.536 . . . . 71.430000000000007 109.553 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.2 m -145.17 137.59 25.97 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.478 -0.328 . . . . 73.109999999999999 110.807 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.82 ' HA ' ' O ' ' A' ' 118' ' ' SER . 18.4 m -82.4 -11.81 58.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 122.104 0.954 . . . . 60.509999999999998 108.46 174.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 174.32 -31.34 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.306 -1.77 . . . . 72.209999999999994 106.384 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.2 m -158.84 165.02 35.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 113.766 -1.561 . . . . 53.32 106.91 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -125.02 141.26 52.24 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.97 -0.692 . . . . 64.299999999999997 111.588 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -158.61 158.38 33.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.342 -0.844 . . . . 74.230000000000004 109.573 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -155.71 -167.85 17.83 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.673 -0.775 . . . . 61.329999999999998 111.561 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -160.95 166.23 28.68 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.44 -0.207 . . . . 62.420000000000002 110.44 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -72.69 144.88 47.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.928 0.394 . . . . 63.520000000000003 110.851 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -151.9 151.16 30.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.21 -0.45 . . . . 71.420000000000002 110.403 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 30.1 t -165.55 158.54 15.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.401 -0.363 . . . . 74.129999999999995 110.222 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 69.9 m -164.73 121.1 1.5 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.014 -0.736 . . . . 74.329999999999998 109.014 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 m -142.12 104.77 4.52 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.991 0.424 . . . . 71.420000000000002 111.02 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -159.3 153.73 24.07 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.852 -0.613 . . . . 64.439999999999998 109.64 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -164.14 105.74 0.9 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.874 0.368 . . . . 64.040000000000006 110.989 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -89.29 160.37 16.93 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.06 -0.719 . . . . 73.120000000000005 109.06 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.9 m -162.58 135.88 5.99 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.983 -0.377 . . . . 40.340000000000003 109.983 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.3 m -157.87 163.41 37.97 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.476 -0.564 . . . . 54.100000000000001 109.476 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.313 -1.003 0 CA-C-O 118.545 -0.74 . . . . 73.430000000000007 110.242 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 110.234 -0.284 . . . . 73.150000000000006 110.234 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.9 mmt -99.29 32.77 2.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.04 0.447 . . . . 62.240000000000002 110.662 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -171.91 171.7 5.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.869 -0.605 . . . . 22.210000000000001 109.939 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.3 m -78.52 124.54 28.26 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 110.083 -0.34 . . . . 64.099999999999994 110.083 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -78.38 -35.59 47.1 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 110.208 -0.293 . . . . 71.120000000000005 110.208 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 7' ' ' ARG . 9.5 t70 60.33 -160.77 0.29 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.672 -0.695 . . . . 72.319999999999993 110.206 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.413 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 0.6 OUTLIER -98.26 176.96 5.53 Favored 'General case' 0 C--N 1.316 -0.848 0 O-C-N 122.291 -0.256 . . . . 63.420000000000002 110.571 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.16 136.38 8.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.173 0.511 . . . . 64.409999999999997 111.665 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.3 m -155.86 128.77 7.99 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.267 -0.878 . . . . 61.32 108.915 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.85 117.48 11.42 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.086 -0.578 . . . . 65.120000000000005 112.321 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.71 -168.73 0.51 Allowed 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.747 2.298 . . . . 64.510000000000005 111.954 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.77 149.93 11.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.872 -0.604 . . . . 72.129999999999995 109.391 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -156.64 153.5 28.66 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.078 -0.342 . . . . 74.230000000000004 110.078 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.418 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 9.9 t -85.99 133.51 41.02 Favored Pre-proline 0 C--N 1.307 -1.248 0 CA-C-N 116.551 -0.295 . . . . 51.520000000000003 110.289 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 14' ' ' THR . 31.8 Cg_exo -61.31 132.41 41.09 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.372 2.048 . . . . 74.319999999999993 111.047 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -77.31 84.96 3.75 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.872 0.367 . . . . 63.329999999999998 111.091 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 p -94.27 91.68 3.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.81 0.814 . . . . 74.099999999999994 110.379 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.72 152.97 9.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-N 115.622 -0.717 . . . . 74.519999999999996 109.958 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.8 170.74 16.47 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.297 -0.631 . . . . 74.150000000000006 109.297 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -164.95 127.28 2.19 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 120.596 0.236 . . . . 70.549999999999997 110.476 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -170.12 175.32 5.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.021 -0.536 . . . . 71.319999999999993 110.018 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.38 137.36 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 109.95 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.1 m -83.76 127.24 33.65 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.185 -0.462 . . . . 72.530000000000001 110.688 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -164.61 122.56 1.71 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.949 -0.569 . . . . 63.130000000000003 110.051 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -165.57 151.68 9.59 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.132 -0.486 . . . . 71.439999999999998 109.747 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -161.3 164.8 29.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.094 0.473 . . . . 75.420000000000002 111.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -150.58 103.33 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 115.397 -0.819 . . . . 74.120000000000005 109.891 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -82.41 100.23 9.89 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.697 -0.683 . . . . 75.209999999999994 110.594 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.5 p -125.06 141.92 43.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.982 -0.554 . . . . 72.010000000000005 110.37 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -155.1 -23.06 0.12 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.07 0.462 . . . . 62.25 110.675 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -146.81 85.68 6.98 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.048 0.452 . . . . 70.409999999999997 110.425 178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -81.36 165.53 18.64 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.093 2.529 . . . . 74.109999999999999 112.113 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -67.11 140.52 54.31 Favored 'Trans proline' 0 C--O 1.241 0.651 0 C-N-CA 122.622 2.214 . . . . 65.129999999999995 112.387 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.38 149.08 98.17 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.821 -0.627 . . . . 63.340000000000003 110.86 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.51 51.5 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.063 2.509 . . . . 53.149999999999999 112.648 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.8 m -84.17 136.07 23.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 116.112 -0.494 . . . . 64.439999999999998 110.656 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.7 m 56.05 79.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.382 0.611 . . . . 71.129999999999995 110.685 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -112.34 109.86 19.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.961 -0.563 . . . . 75.510000000000005 111.205 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.96 141.25 15.21 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.935 -0.65 . . . . 75.0 111.601 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.78 172.5 8.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.799 0.333 . . . . 75.430000000000007 111.055 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -161.62 140.38 9.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.199 -0.455 . . . . 75.510000000000005 110.396 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 24.0 ptp -157.07 144.06 13.53 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.88 -0.6 . . . . 64.430000000000007 109.882 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 42' ' ' MET . 4.5 Cg_exo -74.94 117.41 4.91 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.43 2.087 . . . . 73.530000000000001 111.724 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -87.62 -31.53 19.77 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.133 0.492 . . . . 71.510000000000005 110.648 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.97 -164.6 0.9 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.619 -0.719 . . . . 73.25 110.549 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.3 m 71.47 26.31 3.26 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.094 0.558 . . . . 72.040000000000006 111.797 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.9 t -125.09 101.46 7.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.078 0.466 . . . . 62.450000000000003 110.643 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.37 -27.7 46.96 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.994 -0.548 . . . . 71.239999999999995 109.846 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.1 m 55.62 69.29 0.75 Allowed 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.48 -0.782 . . . . 73.409999999999997 110.846 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.1 151.81 10.48 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.48 -0.782 . . . . 72.219999999999999 109.963 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' CD ' ' H ' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -81.53 138.04 47.93 Favored Pre-proline 0 C--N 1.311 -1.086 0 CA-C-N 116.465 -0.334 . . . . 74.310000000000002 110.265 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 39.2 Cg_exo -61.1 105.78 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.343 2.029 . . . . 74.120000000000005 111.064 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' O ' HD12 ' A' ' 53' ' ' LEU . 3.8 pp -76.35 138.43 67.78 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.181 -0.463 . . . . 52.140000000000001 111.417 -178.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.21 175.56 9.76 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.467 2.112 . . . . 73.049999999999997 111.78 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -140.14 173.32 10.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.977 -0.556 . . . . 74.120000000000005 109.835 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -166.08 -171.66 2.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.681 0.276 . . . . 64.310000000000002 110.777 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 t -73.26 158.94 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.88 -0.6 . . . . 70.120000000000005 109.77 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.35 125.9 91.77 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.297 -0.411 . . . . 41.009999999999998 111.56 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.05 -179.36 4.92 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 123.198 2.598 . . . . 70.239999999999995 111.333 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 m -75.83 154.09 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.147 -0.686 . . . . 72.5 109.147 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.425 HD23 HD11 ' A' ' 93' ' ' LEU . 26.4 tp -90.6 102.21 14.95 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.333 0.587 . . . . 75.140000000000001 111.182 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -133.54 79.38 1.82 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.791 . . . . 74.310000000000002 109.84 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.76 156.28 77.5 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.512 -0.767 . . . . 74.150000000000006 109.588 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.94 116.78 3.25 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.421 2.08 . . . . 55.530000000000001 111.317 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.91 137.64 51.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.1 0.476 . . . . 73.400000000000006 110.798 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.02 -39.94 2.72 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.27 -0.732 . . . . 32.049999999999997 111.27 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 17.9 m -60.28 157.13 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 122.756 0.422 . . . . 64.129999999999995 111.399 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -61.85 -32.35 72.68 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.952 -0.567 . . . . 71.420000000000002 112.005 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -62.45 -46.09 90.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.777 0.322 . . . . 71.530000000000001 111.219 -178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -65.88 -42.13 90.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.228 -0.442 . . . . 71.409999999999997 110.022 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -64.9 -45.68 84.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.195 -0.457 . . . . 73.109999999999999 111.122 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -58.28 -41.87 85.32 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 73.120000000000005 111.294 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.0 m -64.18 -43.13 96.06 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.736 -0.468 . . . . 71.120000000000005 109.736 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -54.27 -48.05 71.63 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.735 -0.666 . . . . 74.319999999999993 110.517 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.8 m -56.34 -46.68 79.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.502 -0.317 . . . . 74.219999999999999 111.03 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -57.99 -53.87 53.37 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.081 0.4 . . . . 72.030000000000001 112.081 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.41 ' NE2' HD12 ' A' ' 91' ' ' LEU . 4.7 pt20 -58.54 -31.56 68.06 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.491 0.552 . . . . 64.409999999999997 112.491 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.405 ' O ' ' HD2' ' A' ' 81' ' ' PHE . 58.6 t -83.37 -35.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.993 0.425 . . . . 74.129999999999995 110.77 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.515 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 92.4 mtp -69.3 -21.22 63.88 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.899 -0.408 . . . . 75.209999999999994 109.899 177.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.0 tp -55.12 -40.65 70.75 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.777 -0.647 . . . . 72.120000000000005 109.835 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 78' ' ' VAL . 82.0 m-85 -50.38 -51.18 48.3 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.713 -0.676 . . . . 71.5 111.785 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.8 t -79.72 -14.82 58.47 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.722 -0.391 . . . . 72.319999999999993 111.518 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 79' ' ' MET . 39.5 mmt180 -74.55 -59.56 2.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.958 0.409 . . . . 70.120000000000005 110.576 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.73 -28.68 24.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 73.549999999999997 112.18 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.55 34.11 3.95 Favored Glycine 0 C--N 1.318 -0.432 0 C-N-CA 120.544 -0.836 . . . . 64.420000000000002 111.847 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -89.96 -176.13 4.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.13 -0.322 . . . . 63.420000000000002 110.13 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -159.9 -4.38 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 60.240000000000002 111.697 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.6 p -144.22 138.49 28.07 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 110.259 -0.275 . . . . 63.5 110.259 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -154.81 152.08 29.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.234 -0.439 . . . . 65.340000000000003 111.076 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 48.7 mt-30 -140.6 115.06 9.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.553 -0.749 . . . . 71.239999999999995 109.739 178.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.41 HD12 ' NE2' ' A' ' 77' ' ' GLN . 83.0 mt -119.18 166.0 13.5 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 110.125 -0.324 . . . . 71.099999999999994 110.125 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.7 mpt_? -81.89 129.52 34.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.975 0.417 . . . . 73.150000000000006 110.071 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -133.98 160.43 37.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 112.488 -175.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.647 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 39.0 m80 -109.24 153.22 42.78 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.581 -1.19 . . . . 70.5 109.081 176.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.647 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 10.8 Cg_endo -53.9 143.21 13.24 Favored 'Cis proline' 0 C--N 1.362 1.277 0 C-N-CA 124.61 -0.996 . . . . 62.409999999999997 113.713 1.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -46.96 -39.91 13.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 114.686 -1.143 . . . . 73.340000000000003 111.767 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -44.06 -36.95 2.76 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.766 0.654 . . . . 64.120000000000005 112.766 175.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.48 -40.27 96.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.564 0.221 . . . . 74.129999999999995 111.215 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.03 -43.75 1.25 Allowed Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.471 -0.395 . . . . 73.549999999999997 113.959 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -159.73 178.11 10.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.346 0.573 . . . . 64.340000000000003 110.822 -178.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 73.4 t -138.5 133.02 42.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.344 -0.984 . . . . 72.329999999999998 108.344 176.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -101.84 104.32 15.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.511 -0.313 . . . . 72.530000000000001 110.324 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.3 mp -100.48 112.7 33.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.789 0.328 . . . . 71.129999999999995 110.264 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 13.0 m -111.84 91.04 3.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.12 -0.491 . . . . 74.010000000000005 110.38 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.598 HD11 ' HB1' ' A' ' 112' ' ' ALA . 25.3 tp -87.32 114.98 24.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.404 0.621 . . . . 61.140000000000001 112.084 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -106.67 91.49 3.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.981 . . . . 75.540000000000006 110.584 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 68.5 tp -82.1 99.61 9.3 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.337 0.589 . . . . 74.230000000000004 110.65 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -105.52 150.7 25.11 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.776 -1.194 . . . . 73.319999999999993 107.776 177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.0 t70 45.01 -94.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.751 0.421 . . . . 63.039999999999999 111.342 -174.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -145.77 21.4 1.46 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.655 -0.498 . . . . 70.439999999999998 109.655 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -121.82 124.21 43.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 73.019999999999996 110.583 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.598 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -91.97 122.59 34.62 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.688 -0.687 . . . . 71.099999999999994 112.704 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 47.9 tt0 -100.89 113.53 26.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.303 -0.862 . . . . 75.430000000000007 110.541 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.9 mt -97.7 107.26 19.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.311 -0.404 . . . . 73.019999999999996 110.956 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 40.0 mt-30 -95.94 126.28 41.08 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.974 -0.38 . . . . 74.409999999999997 109.974 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.468 ' SD ' HD11 ' A' ' 127' ' ' LEU . 60.8 mtt -141.16 148.6 40.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.925 0.393 . . . . 75.420000000000002 110.557 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 151' ' ' SER . 99.7 t -126.13 113.82 35.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.472 -0.566 . . . . 63.329999999999998 109.472 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.1 p -155.54 129.04 4.47 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 116.734 -0.212 . . . . 74.120000000000005 110.84 -177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.21 177.01 0.16 Allowed 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 123.909 3.073 . . . . 54.149999999999999 112.759 176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -84.81 112.29 20.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.574 0.702 . . . . 74.150000000000006 110.163 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.1 m -152.35 172.34 16.62 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.642 -1.163 . . . . 65.510000000000005 108.112 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -68.36 -22.37 64.67 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.581 0.586 . . . . 72.409999999999997 112.581 -177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 10.5 m -65.85 -29.16 46.06 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 120.81 -0.356 . . . . 74.329999999999998 110.251 174.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 33.8 ttp85 -67.42 -39.92 85.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.909 -0.587 . . . . 45.240000000000002 110.283 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.79 -47.54 85.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.586 . . . . 32.009999999999998 110.288 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.56 -0.745 . . . . 65.129999999999995 111.104 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.468 HD11 ' SD ' ' A' ' 116' ' ' MET . 3.0 tm? -66.28 -56.0 13.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.161 -0.472 . . . . 73.019999999999996 109.856 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -62.61 -39.57 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.150000000000006 110.678 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.563 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -63.49 -29.76 70.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.158 -0.473 . . . . 52.200000000000003 112.272 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -76.75 -18.59 58.38 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.341 0.497 . . . . 62.140000000000001 112.341 -178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.8 mt -62.63 -51.13 74.62 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 112.423 0.527 . . . . 74.019999999999996 112.423 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.563 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 42.0 Cg_exo -59.22 -27.67 85.63 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.25 1.966 . . . . 75.200000000000003 112.124 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.559 ' O ' HG22 ' A' ' 136' ' ' THR . 38.9 ttp -75.45 -41.44 55.75 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.377 0.608 . . . . 60.229999999999997 110.032 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 62.1 tp -75.76 -37.58 59.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.595 -0.73 . . . . 62.109999999999999 111.591 -177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 0.0 OUTLIER -57.7 -30.27 65.36 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.168 0.433 . . . . 71.230000000000004 112.168 -178.503 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 133' ' ' MET . 5.4 t -76.68 -31.05 57.03 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 120.333 -0.547 . . . . 73.349999999999994 110.414 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -69.93 -45.69 66.94 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 121.043 0.449 . . . . 75.25 110.335 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.04 -25.56 65.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.19 0.519 . . . . 72.129999999999995 110.71 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -62.92 -28.23 69.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.776 -0.647 . . . . 74.439999999999998 110.583 178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.86 -20.05 63.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.877 -0.601 . . . . 64.349999999999994 110.957 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.8 m -99.79 1.69 43.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.111 0.481 . . . . 71.040000000000006 110.456 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 81.41 43.9 8.28 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.833 -0.699 . . . . 62.219999999999999 111.385 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 73.7 mt -129.24 126.91 64.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 109.741 -0.466 . . . . 75.310000000000002 109.741 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -95.27 96.63 9.3 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.036 0.446 . . . . 64.219999999999999 110.92 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 68.1 tp -88.84 117.17 27.64 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.302 -0.408 . . . . 74.140000000000001 110.024 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -156.9 -44.27 0.02 OUTLIER Glycine 0 CA--C 1.497 -1.067 0 N-CA-C 110.732 -0.947 . . . . 71.329999999999998 110.732 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 24.3 mp0 -66.01 116.52 7.22 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.672 -0.492 . . . . 43.030000000000001 109.672 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 24.0 m -140.24 121.19 14.58 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.04 0.448 . . . . 64.049999999999997 110.304 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 6.8 m -99.08 106.27 18.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.785 -0.82 . . . . 63.009999999999998 108.785 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.8 mt -116.28 120.33 64.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 N-CA-C 109.756 -0.461 . . . . 64.099999999999994 109.756 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 42.6 m -135.03 138.71 44.18 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.208 -0.451 . . . . 71.120000000000005 110.549 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.9 m -83.12 -24.39 32.62 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.311 0.577 . . . . 73.120000000000005 110.145 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -160.33 -42.88 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.25 -0.887 . . . . 64.030000000000001 109.607 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 32.3 p -155.86 166.08 34.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.65 -0.705 . . . . 73.420000000000002 109.235 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -82.51 117.83 22.81 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.83 0.347 . . . . 74.319999999999993 110.674 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -81.95 110.41 17.19 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.101 -0.5 . . . . 51.399999999999999 110.706 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -128.21 56.88 0.72 Allowed Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 111.317 -0.713 . . . . 73.510000000000005 111.317 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -78.36 153.66 31.44 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.948 0.404 . . . . 75.030000000000001 111.078 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -158.52 86.37 0.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.361 0.6 . . . . 74.209999999999994 109.496 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . 0.434 ' H ' ' CD ' ' A' ' 160' ' ' GLN . 0.7 OUTLIER -90.93 149.02 22.05 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.364 -0.835 . . . . 74.310000000000002 111.323 -178.199 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 11.6 p -127.29 134.47 50.02 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.013 -0.54 . . . . 75.150000000000006 109.826 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 11.0 p -168.71 141.85 2.92 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.576 -0.283 . . . . 43.32 111.296 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t 70.58 155.77 0.15 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.541 0.736 . . . . 73.329999999999998 111.823 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -77.05 135.74 38.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 64.519999999999996 110.632 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -78.91 -18.94 53.01 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.769 0.318 . . . . 75.200000000000003 111.064 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -80.37 136.66 36.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.61 -0.515 . . . . 64.239999999999995 109.61 177.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 26.8 m -160.18 17.99 0.15 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.879 0.371 . . . . 74.519999999999996 110.476 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 61.8 p -164.52 160.29 20.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.181 -0.463 . . . . 74.319999999999993 110.447 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 . . . . . 0 C--N 1.316 -0.864 0 CA-C-O 118.431 -0.795 . . . . 71.319999999999993 109.756 177.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 50.4 m80 . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.901 0.381 . . . . 73.209999999999994 110.657 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -131.58 151.45 51.59 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.211 -0.45 . . . . 74.310000000000002 109.975 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -170.21 138.36 1.62 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.421 -0.354 . . . . 63.049999999999997 110.448 -179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.2 t -164.9 115.23 1.14 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.999 -0.546 . . . . 61.340000000000003 109.812 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.86 -66.04 0.94 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.335 -0.393 . . . . 73.230000000000004 109.995 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.4 t0 61.32 163.41 0.07 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.61 -0.723 . . . . 70.209999999999994 112.232 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 7' ' ' ARG . 6.5 ppt_? -82.05 153.78 25.96 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.282 -0.417 . . . . 74.319999999999993 110.934 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -163.84 88.33 0.54 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.08 0.467 . . . . 70.519999999999996 110.511 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -155.18 170.3 22.15 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.687 -0.688 . . . . 70.319999999999993 109.742 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.6 -114.06 3.91 Favored Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.723 -0.751 . . . . 34.149999999999999 111.728 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -83.17 -161.43 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.912 2.408 . . . . 73.120000000000005 111.505 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.48 149.24 15.08 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.337 -0.392 . . . . 75.329999999999998 110.075 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.6 mt -150.23 141.48 23.2 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.107 -0.497 . . . . 52.219999999999999 109.971 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 p -86.38 143.06 35.96 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.933 -0.576 . . . . 72.319999999999993 110.714 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.31 112.68 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.552 2.168 . . . . 73.129999999999995 111.368 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -151.0 103.99 3.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.015 0.436 . . . . 64.010000000000005 110.705 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -91.79 154.26 3.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.823 -0.626 . . . . 71.209999999999994 109.889 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -82.05 132.5 31.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.065 0.459 . . . . 64.340000000000003 110.494 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.39 120.11 15.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.009 -0.541 . . . . 50.009999999999998 111.696 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.45 114.12 12.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.011 -0.54 . . . . 71.420000000000002 110.134 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.4 137.59 2.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.627 -0.261 . . . . 71.219999999999999 110.636 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.11 141.89 3.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 52.109999999999999 110.367 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 p -83.79 113.4 20.89 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.853 -0.425 . . . . 71.430000000000007 109.853 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.2 m -156.86 14.31 0.27 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.783 0.325 . . . . 73.409999999999997 110.942 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.92 92.86 2.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.384 -0.371 . . . . 71.420000000000002 110.938 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -80.52 103.34 10.31 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.315 -0.402 . . . . 72.120000000000005 110.575 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.43 113.88 29.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.305 0.574 . . . . 72.310000000000002 110.754 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -158.18 109.57 2.22 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.926 -0.579 . . . . 72.319999999999993 109.716 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -114.65 170.7 4.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 116.356 -0.384 . . . . 74.400000000000006 111.305 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -161.01 102.91 1.29 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.689 -0.687 . . . . 65.519999999999996 109.356 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -83.11 118.7 72.47 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.999 -0.546 . . . . 73.150000000000006 111.591 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -85.25 132.19 4.38 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.592 2.194 . . . . 75.239999999999995 111.949 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.44 130.91 35.69 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.493 2.129 . . . . 65.030000000000001 111.67 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.47 121.08 83.89 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.511 . . . . 73.140000000000001 111.123 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.82 170.05 20.57 Favored 'Trans proline' 0 C--O 1.241 0.657 0 C-N-CA 122.523 2.149 . . . . 71.150000000000006 111.932 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.8 p -88.59 130.92 37.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.266 -0.424 . . . . 71.230000000000004 110.406 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.7 t -87.69 147.86 25.04 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.432 -0.349 . . . . 72.209999999999994 110.431 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 -120.73 169.12 10.7 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.373 -0.376 . . . . 75.040000000000006 110.207 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 137.65 128.1 2.62 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.38 -0.914 . . . . 61.240000000000002 112.556 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 139.37 4.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.956 -0.387 . . . . 53.149999999999999 109.956 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.66 161.5 18.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.835 0.35 . . . . 75.430000000000007 111.153 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.9 tpt -159.5 85.57 2.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.779 -0.646 . . . . 75.450000000000003 109.306 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -76.99 119.53 5.12 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.805 2.337 . . . . 71.010000000000005 112.885 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 t -157.92 113.48 2.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 110.51 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -154.99 119.33 4.71 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.206 -0.452 . . . . 72.109999999999999 111.112 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 m 67.24 161.5 0.17 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.963 0.727 . . . . 32.43 112.963 176.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -98.35 -37.77 9.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.724 -0.671 . . . . 72.140000000000001 109.272 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 69.92 132.91 0.03 OUTLIER 'General case' 0 C--N 1.35 0.609 0 C-N-CA 124.008 0.923 . . . . 70.200000000000003 112.027 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.7 m -85.02 99.12 10.81 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.104 0.478 . . . . 72.400000000000006 110.082 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.12 -20.24 59.52 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.798 -0.637 . . . . 40.25 111.167 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -79.57 126.21 81.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.198 -0.456 . . . . 74.299999999999997 110.927 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.37 166.89 28.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.921 2.414 . . . . 63.439999999999998 111.654 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 74.6 mt -112.37 101.54 52.48 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-O 120.89 0.376 . . . . 75.409999999999997 110.543 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HB2' ' H ' ' A' ' 55' ' ' VAL . 71.9 Cg_endo -88.66 -149.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.184 2.589 . . . . 71.439999999999998 111.812 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.402 ' H ' ' HB2' ' A' ' 54' ' ' PRO . 4.0 p -150.39 93.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.738 0.78 . . . . 75.010000000000005 110.161 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.89 116.59 10.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.258 -0.883 . . . . 73.239999999999995 111.198 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.2 m 60.24 79.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.504 -0.771 . . . . 71.120000000000005 111.948 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.89 131.35 81.71 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.886 -0.597 . . . . 44.520000000000003 110.47 178.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.23 178.9 7.07 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.765 2.31 . . . . 61.420000000000002 111.517 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.88 166.38 2.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 121.001 0.429 . . . . 73.409999999999997 110.317 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.549 HD21 ' CD1' ' A' ' 70' ' ' TRP . 9.3 tt -88.13 117.01 26.73 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.137 0.494 . . . . 53.340000000000003 110.667 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.1 m -135.01 79.69 1.8 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.472 0.653 . . . . 70.239999999999995 110.086 175.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.24 154.64 75.78 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.073 -0.967 . . . . 62.509999999999998 109.556 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.16 127.62 24.25 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.81 2.34 . . . . 64.120000000000005 111.912 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.24 116.94 11.17 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.229 -0.442 . . . . 75.540000000000006 110.916 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.88 -23.01 17.9 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.891 -0.671 . . . . 72.230000000000004 112.232 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 35.8 t -57.46 148.45 23.48 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 122.666 0.386 . . . . 54.200000000000003 111.524 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.58 -43.99 97.85 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.456 -0.572 . . . . 75.420000000000002 109.456 177.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.55 -35.96 73.17 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.642 -0.708 . . . . 74.430000000000007 110.621 176.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.549 ' CD1' HD21 ' A' ' 61' ' ' LEU . 82.8 t90 -67.58 -42.79 81.96 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 74.049999999999997 109.924 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 67' ' ' SER . 43.1 mt-30 -63.84 -47.67 79.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.543 -0.299 . . . . 53.140000000000001 110.204 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -54.38 -47.85 72.19 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.276 -0.42 . . . . 65.200000000000003 111.028 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 33.4 m -63.74 -42.66 97.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.044 0.45 . . . . 73.239999999999995 110.095 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.74 -54.29 47.92 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.725 -0.671 . . . . 75.230000000000004 110.507 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.4 p -58.61 -46.33 87.27 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.303 0.482 . . . . 55.539999999999999 112.303 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -53.94 -43.76 70.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.669 0.271 . . . . 71.239999999999995 111.177 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -57.47 -43.28 83.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.909 -0.587 . . . . 75.519999999999996 111.161 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.6 t -77.32 -37.32 25.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.302 -0.408 . . . . 73.140000000000001 110.576 -176.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 88.4 mtp -63.38 -45.15 92.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.656 -0.498 . . . . 64.340000000000003 109.656 177.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.63 -41.81 74.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.666 -0.697 . . . . 63.420000000000002 110.738 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.2 m-30 -57.03 -57.51 12.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.312 -0.403 . . . . 75.299999999999997 111.993 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.7 t -63.88 -24.25 67.67 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.904 0.335 . . . . 42.240000000000002 111.904 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.4 mtp180 -71.35 -40.62 70.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.274 0.559 . . . . 75.25 109.878 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -80.75 -28.71 36.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.291 -0.868 . . . . 72.519999999999996 111.405 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 122.28 -5.89 10.12 Favored Glycine 0 C--O 1.233 0.069 0 C-N-CA 120.844 -0.693 . . . . 63.109999999999999 112.51 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.06 159.91 25.99 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.424 -0.584 . . . . 71.230000000000004 109.424 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 105' ' ' LEU . 20.8 pt20 -161.12 14.7 0.1 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.557 0.694 . . . . 53.409999999999997 110.154 -178.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 20.1 m -151.57 133.7 15.16 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.139 -1.06 . . . . 61.409999999999997 108.139 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.91 166.67 29.7 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 72.340000000000003 111.922 -174.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.511 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 26.2 mp0 -111.51 117.48 33.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.368 -0.833 . . . . 73.329999999999998 108.894 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.6 tp -103.56 123.64 47.3 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 120.984 0.421 . . . . 72.519999999999996 111.901 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -78.42 147.61 33.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.789 -0.641 . . . . 62.329999999999998 109.333 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.8 mt -143.25 144.52 32.17 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.269 -0.423 . . . . 72.140000000000001 110.055 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.453 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 9.5 m-70 -111.03 132.94 21.43 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 110.213 -0.291 . . . . 72.040000000000006 110.213 176.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.453 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 55.8 Cg_endo -69.1 147.75 83.88 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.492 -1.462 . . . . 74.409999999999997 112.193 0.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -75.92 24.37 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.135 0.791 . . . . 74.010000000000005 113.135 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.86 -51.59 60.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.611 0.243 . . . . 63.119999999999997 110.372 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.5 mt -59.68 -32.95 70.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.95 0.405 . . . . 72.329999999999998 110.933 176.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.19 -44.5 1.62 Allowed Glycine 0 CA--C 1.521 0.414 0 CA-C-N 116.042 -0.526 . . . . 60.520000000000003 114.334 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -151.64 156.65 40.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.372 0.586 . . . . 74.129999999999995 111.825 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 91.6 t -139.3 129.41 31.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 107.863 -1.162 . . . . 53.420000000000002 107.863 176.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -106.38 107.68 18.8 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.506 -0.478 . . . . 73.510000000000005 110.53 -177.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.4 mp -88.81 121.49 39.04 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.386 -0.37 . . . . 75.239999999999995 110.272 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.9 m -109.1 164.6 12.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.382 -0.826 . . . . 65.030000000000001 108.862 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 87' ' ' GLN . 58.1 tp -152.78 127.49 9.47 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.955 -0.298 . . . . 74.519999999999996 110.831 -176.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -111.79 131.93 55.0 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.607 -0.516 . . . . 63.340000000000003 109.607 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 53.2 tp -132.97 116.3 16.25 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 109.757 -0.461 . . . . 74.140000000000001 109.757 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -148.5 142.15 25.51 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.291 -0.413 . . . . 73.239999999999995 110.196 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.9 t70 55.88 -97.31 0.07 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.456 0.702 . . . . 72.519999999999996 111.563 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -142.24 28.13 1.71 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.676 0.751 . . . . 72.510000000000005 110.036 178.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -141.09 149.4 41.55 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.698 -0.683 . . . . 74.519999999999996 110.169 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.522 ' HB3' HD23 ' A' ' 145' ' ' LEU . . . -128.64 142.26 51.09 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.07 -0.513 . . . . 75.409999999999997 111.325 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 63.2 tt0 -114.98 130.56 56.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.567 -0.742 . . . . 75.120000000000005 110.579 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.01 139.33 36.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.072 -0.513 . . . . 65.049999999999997 111.569 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 129.28 19.58 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.071 -1.085 . . . . 75.120000000000005 108.071 177.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.403 ' HG3' HG13 ' A' ' 103' ' ' ILE . 4.5 mpp? -130.73 130.2 43.49 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.695 -0.854 . . . . 73.099999999999994 108.695 -176.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 44.4 t -97.09 120.08 45.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.154 0.502 . . . . 60.140000000000001 110.803 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 152' ' ' SER . 25.8 p -164.05 148.31 8.36 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.81 -1.087 . . . . 44.439999999999998 108.759 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -53.02 158.17 7.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.424 2.083 . . . . 74.519999999999996 111.719 177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -86.8 130.81 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.3 -0.56 . . . . 61.43 110.494 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.6 t -172.48 -177.1 1.68 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.517 -0.765 . . . . 75.409999999999997 109.165 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -62.73 -16.62 58.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.578 -0.283 . . . . 74.510000000000005 110.81 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 26.7 m -56.13 -26.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.277 -0.42 . . . . 71.030000000000001 111.551 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -56.23 -40.07 73.5 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.271 -0.422 . . . . 65.409999999999997 110.576 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.3 76.03 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 55.539999999999999 111.226 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.9 -47.39 52.97 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.045 -0.525 . . . . 54.350000000000001 111.713 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.56 -42.62 82.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.702 0.286 . . . . 60.119999999999997 111.334 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -65.04 -42.07 94.66 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.162 -0.472 . . . . 74.049999999999997 110.061 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -57.03 -31.5 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.495 0.554 . . . . 73.120000000000005 112.495 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.15 -11.63 59.98 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.235 0.457 . . . . 75.519999999999996 112.235 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 80.2 mt -68.25 -50.11 30.64 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 112.242 0.46 . . . . 73.349999999999994 112.242 -177.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.494 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 48.6 Cg_exo -58.43 -28.48 85.37 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.099 1.866 . . . . 61.509999999999998 111.937 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.44 -37.5 36.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.5 0.667 . . . . 71.430000000000007 109.532 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.2 tp -71.93 -37.5 70.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.149 -0.932 . . . . 74.25 110.762 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.45 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 8.4 ptm180 -64.5 -24.94 67.78 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.856 0.36 . . . . 75.0 110.295 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.5 m -81.86 -35.16 29.63 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.081 -0.509 . . . . 73.439999999999998 109.778 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.418 ' HB3' ' SD ' ' A' ' 79' ' ' MET . 14.1 mm100 -69.09 -44.04 73.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.82 -0.627 . . . . 61.32 110.597 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.06 -27.76 63.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.928 -0.578 . . . . 74.329999999999998 111.063 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HA ' ' O ' ' A' ' 143' ' ' ILE . . . -62.65 -31.07 71.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.462 0.649 . . . . 71.230000000000004 110.279 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.93 -16.71 64.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.047 -0.979 . . . . 74.230000000000004 110.582 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.6 m -107.25 3.81 25.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.897 -0.592 . . . . 63.420000000000002 111.144 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 101.33 -19.82 49.56 Favored Glycine 0 C--O 1.225 -0.408 0 C-N-CA 120.349 -0.929 . . . . 65.329999999999998 113.855 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 139' ' ' ALA . 3.5 mp -87.17 151.38 3.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 117.007 0.403 . . . . 74.519999999999996 110.954 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -135.44 131.26 35.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.247 -0.433 . . . . 72.120000000000005 110.818 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.522 HD23 ' HB3' ' A' ' 112' ' ' ALA . 91.9 mt -98.52 129.76 45.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.976 -0.556 . . . . 70.230000000000004 109.617 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -121.59 -51.65 0.24 Allowed Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.482 -0.866 . . . . 60.009999999999998 111.577 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 17.4 mt-30 -103.24 135.06 45.6 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.771 -0.826 . . . . 75.439999999999998 108.771 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.6 m -161.19 120.66 2.58 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.298 -0.251 . . . . 75.030000000000001 110.384 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 66.7 m -147.12 133.3 19.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.45 -0.341 . . . . 51.020000000000003 111.781 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.37 136.05 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 109.485 -0.561 . . . . 72.340000000000003 109.485 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 34.8 t -105.73 135.85 46.41 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.793 -0.447 . . . . 74.129999999999995 109.793 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 118' ' ' SER . 33.5 t -81.86 -32.68 30.99 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.949 -0.389 . . . . 60.219999999999999 109.949 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -165.69 -37.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.094 -0.503 . . . . 72.140000000000001 110.955 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 22.7 t -150.29 -163.91 1.89 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.144 -0.687 . . . . 74.120000000000005 109.144 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -78.42 145.31 35.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.639 -0.504 . . . . 63.399999999999999 109.639 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.06 139.04 14.39 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.816 0.341 . . . . 75.319999999999993 110.771 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 158.97 165.04 15.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 111.35 -0.7 . . . . 55.109999999999999 111.35 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -161.38 148.98 15.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.806 0.336 . . . . 75.099999999999994 110.812 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -165.41 135.75 3.7 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.182 -0.673 . . . . 62.119999999999997 109.182 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -151.39 154.2 36.19 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.836 0.351 . . . . 74.409999999999997 110.953 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 59.7 m -152.0 -172.84 4.34 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.555 -0.535 . . . . 54.299999999999997 109.555 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 t -169.46 -166.69 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.749 0.309 . . . . 71.25 110.197 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 20.4 p -79.02 179.29 7.42 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 116.053 -0.522 . . . . 74.0 111.29 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -147.65 147.24 29.78 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.457 -0.571 . . . . 63.409999999999997 109.457 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -77.55 138.04 38.95 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.041 0.448 . . . . 75.409999999999997 111.279 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.01 176.7 4.91 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.726 -0.842 . . . . 64.420000000000002 108.726 176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 p -167.07 155.58 9.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.988 0.423 . . . . 61.409999999999997 111.52 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 50.5 m -157.8 170.67 21.84 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.223 -0.658 . . . . 54.329999999999998 109.223 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.347 -0.835 . . . . 73.219999999999999 110.035 178.567 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 120.654 0.264 . . . . 75.450000000000003 110.756 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 52.1 ttp -75.46 114.26 13.8 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.203 -0.453 . . . . 73.230000000000004 110.193 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.12 122.64 17.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.209 -0.451 . . . . 72.450000000000003 110.527 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 t -159.89 76.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.548 0.69 . . . . 63.100000000000001 109.907 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -83.21 -14.83 52.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.247 -0.888 . . . . 75.329999999999998 111.149 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.39 18.19 11.2 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.663 0.744 . . . . 72.439999999999998 110.541 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HE ' ' HB3' ' A' ' 7' ' ' ARG . 2.7 tmm_? -97.76 145.22 26.59 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.36 -0.836 . . . . 71.219999999999999 109.395 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.35 170.77 20.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.936 0.398 . . . . 74.310000000000002 111.196 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -147.05 152.25 38.24 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.767 -0.651 . . . . 65.340000000000003 110.018 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 11' ' ' PRO . . . 89.49 64.36 1.27 Allowed Glycine 0 C--N 1.315 -0.607 0 C-N-CA 121.071 -0.585 . . . . 61.399999999999999 112.537 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 10' ' ' GLY . 94.8 Cg_endo -92.13 166.72 3.05 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.799 2.332 . . . . 63.450000000000003 112.098 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.92 165.7 24.44 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.855 -0.612 . . . . 65.329999999999998 111.058 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.03 156.51 29.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.254 -0.43 . . . . 75.310000000000002 110.223 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.1 p -84.05 152.12 61.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 116.541 -0.3 . . . . 75.530000000000001 110.582 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -61.8 125.1 15.84 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.624 2.216 . . . . 73.409999999999997 111.797 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.05 110.59 9.48 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.345 -0.389 . . . . 71.519999999999996 110.519 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.44 112.86 20.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.521 0.677 . . . . 73.150000000000006 111.113 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.32 127.17 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.454 -0.794 . . . . 73.120000000000005 110.17 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -168.33 100.04 0.43 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.278 -0.419 . . . . 73.439999999999998 110.636 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.13 139.38 56.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.016 -0.538 . . . . 64.099999999999994 110.281 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.15 148.85 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.47 -0.332 . . . . 63.210000000000001 110.833 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.51 132.63 2.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.742 -0.663 . . . . 72.510000000000005 109.783 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.17 140.32 18.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.036 0.446 . . . . 60.109999999999999 111.24 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 t -170.67 139.97 1.63 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.066 -0.716 . . . . 64.5 109.066 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.99 129.46 1.12 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.709 0.29 . . . . 71.540000000000006 110.779 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -160.91 122.32 2.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.041 -0.527 . . . . 75.510000000000005 109.962 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 p -152.54 147.0 15.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-N 116.341 -0.39 . . . . 73.530000000000001 110.434 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -156.39 106.23 2.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 110.238 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -138.51 109.85 5.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.402 0.62 . . . . 73.430000000000007 111.343 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -162.68 158.86 23.67 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 72.129999999999995 109.709 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 23.2 t -156.9 121.52 2.35 Favored Pre-proline 0 C--N 1.317 -0.835 0 N-CA-C 109.944 -0.391 . . . . 64.349999999999994 109.944 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 31' ' ' SER . 26.5 Cg_exo -64.02 115.42 3.11 Favored 'Trans proline' 0 C--O 1.24 0.582 0 C-N-CA 123.005 2.47 . . . . 51.109999999999999 112.195 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.97 124.37 2.14 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.534 2.156 . . . . 75.239999999999995 111.964 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.54 120.07 79.23 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.183 -0.462 . . . . 53.229999999999997 110.835 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.37 118.08 5.46 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.495 2.13 . . . . 53.43 112.136 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.1 -18.64 8.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.243 -0.435 . . . . 70.099999999999994 110.939 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 p -87.81 117.62 26.77 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.059 -0.519 . . . . 42.5 110.489 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.4 m80 -126.41 110.01 12.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.792 0.329 . . . . 74.409999999999997 110.696 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -129.77 72.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.478 -0.649 . . . . 55.210000000000001 111.478 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.48 -175.48 3.9 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.634 -0.506 . . . . 64.329999999999998 109.634 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 52.8 68.91 0.76 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.303 0.573 . . . . 51.420000000000002 111.007 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 63.9 mtm -144.62 117.77 5.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.867 -0.606 . . . . 73.150000000000006 110.176 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -78.76 155.82 27.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.73 2.287 . . . . 74.310000000000002 112.338 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.5 t -160.8 146.94 14.93 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 116.11 -0.495 . . . . 52.229999999999997 110.189 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt 62.03 -166.58 0.21 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.144 0.578 . . . . 72.150000000000006 111.848 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.7 t -165.55 102.69 0.71 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.01 -0.541 . . . . 75.109999999999999 109.634 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.2 m -116.73 162.74 17.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.273 -0.421 . . . . 71.200000000000003 110.891 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.99 149.76 14.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.895 -0.593 . . . . 74.030000000000001 109.853 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.86 106.09 3.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.979 0.419 . . . . 61.109999999999999 111.388 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.63 88.38 0.41 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 74.030000000000001 109.57 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -85.51 114.29 55.65 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.65 -0.704 . . . . 65.239999999999995 111.822 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.91 107.01 1.98 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.434 2.09 . . . . 74.150000000000006 110.748 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.4 mt -101.39 121.26 52.25 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.33 -0.396 . . . . 64.209999999999994 111.283 -177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.57 159.12 16.77 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.571 2.181 . . . . 62.020000000000003 111.395 177.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t 72.68 143.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.147 0.579 . . . . 74.040000000000006 111.342 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -162.72 138.33 7.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.278 -0.419 . . . . 71.329999999999998 110.724 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.415 ' O ' ' HD3' ' A' ' 59' ' ' PRO . 48.4 t -161.73 147.29 13.52 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.627 -0.879 . . . . 61.219999999999999 108.627 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.54 112.53 15.33 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 120.766 0.317 . . . . 75.340000000000003 111.061 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 57' ' ' SER . 58.3 Cg_endo -101.34 176.6 0.23 Allowed 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 123.281 2.654 . . . . 72.109999999999999 111.535 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.27 149.68 3.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 109.002 -0.74 . . . . 43.039999999999999 109.002 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.6 tp -91.65 88.19 6.63 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.597 0.713 . . . . 43.119999999999997 111.235 -176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.0 m -108.28 75.0 0.96 Allowed 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 115.395 -0.82 . . . . 75.129999999999995 109.939 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HB1' ' HD2' ' A' ' 64' ' ' PRO . . . -136.8 163.27 50.78 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.549 -0.751 . . . . 54.32 109.123 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.413 ' HD2' ' HB1' ' A' ' 63' ' ' ALA . 11.6 Cg_endo -56.55 117.16 3.78 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.283 1.989 . . . . 62.530000000000001 110.76 176.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.5 137.78 57.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.166 0.508 . . . . 75.430000000000007 111.713 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.1 -32.89 5.77 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.745 -0.662 . . . . 74.230000000000004 112.42 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 15.5 m -61.87 151.45 34.56 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.459 0.304 . . . . 71.409999999999997 111.638 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 36.0 m170 -60.44 -38.82 85.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.376 -0.375 . . . . 75.329999999999998 111.033 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -57.98 -39.04 77.22 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.906 -0.588 . . . . 71.040000000000006 110.249 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -71.59 -41.32 69.13 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.647 -0.706 . . . . 75.010000000000005 110.168 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 67' ' ' SER . 51.4 mt-30 -64.49 -49.23 72.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 71.439999999999998 110.738 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 50.1 mm-40 -53.79 -47.52 70.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.388 -0.369 . . . . 74.099999999999994 111.293 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -63.27 -38.72 92.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.075 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.684 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 91.3 t80 -58.51 -49.59 76.82 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.927 -0.579 . . . . 74.200000000000003 110.312 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 79' ' ' MET . 49.8 m -57.39 -47.49 81.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.753 0.279 . . . . 72.140000000000001 111.753 178.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 70.4 mm-40 -56.21 -46.4 79.49 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 111.967 0.358 . . . . 72.400000000000006 111.967 -179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 1.3 pp0? -63.77 -33.07 74.83 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.684 0.278 . . . . 75.120000000000005 111.259 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 74' ' ' PHE . 87.2 t -77.42 -34.47 20.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 120.836 0.35 . . . . 61.130000000000003 110.233 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 92.1 mtp -61.9 -46.07 90.96 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.339 -0.615 . . . . 62.130000000000003 109.339 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.77 -42.39 99.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 72.430000000000007 110.115 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -54.3 -48.59 71.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.718 -0.674 . . . . 73.439999999999998 111.757 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.9 t -72.67 -20.77 61.19 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 121.005 -0.278 . . . . 65.230000000000004 111.505 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 79' ' ' MET . 79.3 mtt180 -71.34 -30.51 66.27 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.039 0.447 . . . . 72.439999999999998 110.241 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -74.08 -24.29 59.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.729 -0.668 . . . . 72.25 110.481 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.95 28.84 44.25 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.707 -0.759 . . . . 63.32 111.814 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.9 -162.64 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.691 0.282 . . . . 73.409999999999997 110.567 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 11.6 pt20 -156.81 -7.24 0.1 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 111.919 0.34 . . . . 75.209999999999994 111.919 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.6 m -149.46 139.92 22.43 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.977 -0.379 . . . . 74.310000000000002 109.977 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.22 142.11 21.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 41.549999999999997 111.214 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -101.29 119.77 39.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.8 -0.637 . . . . 73.420000000000002 109.575 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -103.45 121.09 42.1 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.576 -0.284 . . . . 74.129999999999995 110.937 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 131.75 41.38 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.494 -0.558 . . . . 74.510000000000005 109.494 177.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 23.1 mt -145.02 151.09 38.02 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.306 0.574 . . . . 74.019999999999996 112.153 -178.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 0.8 OUTLIER -121.02 151.37 55.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.1 -0.955 . . . . 73.400000000000006 110.219 176.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 46.0 Cg_endo -67.8 143.4 68.48 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.355 -1.519 . . . . 71.230000000000004 111.424 0.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -61.97 14.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.32 1.6 . . . . 73.040000000000006 115.32 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.17 -59.79 4.85 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.302 -0.999 . . . . 74.340000000000003 108.302 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 mt -63.87 -32.66 74.25 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.082 -0.71 . . . . 45.200000000000003 109.082 173.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.35 -45.2 1.19 Allowed Glycine 0 C--O 1.236 0.279 0 CA-C-N 115.004 -0.998 . . . . 71.239999999999995 115.408 177.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -159.64 178.21 10.08 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 117.64 0.72 . . . . 72.549999999999997 111.584 -176.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.2 t -136.02 134.14 50.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.044 -0.98 . . . . 52.200000000000003 108.485 177.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.501 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 13.5 m170 -97.83 101.58 13.12 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.846 -0.428 . . . . 54.100000000000001 109.846 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.8 mp -94.07 112.66 27.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 120.975 0.417 . . . . 73.25 110.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 20.3 m -97.87 168.43 10.31 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.595 -0.891 . . . . 75.430000000000007 108.595 175.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 34.2 tp -151.96 146.14 25.38 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.154 -0.618 . . . . 54.530000000000001 111.368 -174.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.671 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 88.1 tttt -132.66 128.67 37.54 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.367 -1.346 . . . . 74.140000000000001 107.367 174.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.15 101.99 5.41 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.161 0.505 . . . . 54.109999999999999 110.34 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -140.27 145.72 37.65 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.568 -0.742 . . . . 75.420000000000002 109.314 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.9 t70 58.65 -93.78 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.5 0.5 . . . . 73.230000000000004 110.273 -176.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -150.77 30.18 0.66 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.247 0.546 . . . . 75.120000000000005 109.828 176.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.58 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 0.0 OUTLIER -128.32 138.84 52.57 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.812 -0.631 . . . . 74.129999999999995 110.815 -177.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.671 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.01 126.45 52.9 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.845 -0.616 . . . . 64.530000000000001 110.601 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 34.3 tt0 -94.91 116.43 28.7 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 116.168 -0.469 . . . . 61.100000000000001 109.836 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.426 ' CD2' HD22 ' A' ' 145' ' ' LEU . 4.6 mm? -95.65 106.91 19.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.286 0.565 . . . . 74.129999999999995 111.519 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 39.5 mt-30 -110.31 135.12 51.54 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.178 -1.045 . . . . 74.109999999999999 108.178 176.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 74.5 mtm -139.8 117.34 11.46 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.278 0.561 . . . . 75.430000000000007 111.377 -176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.572 HG13 ' H ' ' A' ' 153' ' ' GLU . 90.5 t -93.91 120.72 43.76 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 115.399 -0.818 . . . . 71.439999999999998 109.627 177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.3 m -161.47 146.69 10.5 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.423 -0.808 . . . . 71.219999999999999 109.661 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.31 171.05 8.43 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 122.463 2.109 . . . . 74.140000000000001 111.437 177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -87.56 124.85 33.92 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.177 0.513 . . . . 75.230000000000004 111.156 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t -172.25 -176.07 1.54 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.379 -0.828 . . . . 54.439999999999998 109.026 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -64.7 -33.52 76.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.564 0.221 . . . . 61.329999999999998 110.731 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 66.6 t -60.47 -34.58 58.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 120.784 0.326 . . . . 75.519999999999996 110.46 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -61.49 -42.27 98.54 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.444 -0.576 . . . . 71.349999999999994 109.444 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.29 -38.27 81.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.912 -0.585 . . . . 52.530000000000001 110.259 178.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.17 85.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.707 -0.678 . . . . 74.5 111.027 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 123' ' ' VAL . 97.5 mt -64.73 -41.76 95.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.997 0.427 . . . . 63.450000000000003 110.048 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.776 -0.647 . . . . 75.420000000000002 109.957 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -60.92 -21.8 63.73 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 75.439999999999998 112.373 177.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.29 -15.66 58.52 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.676 0.25 . . . . 75.409999999999997 111.676 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.426 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 98.7 mt -68.41 -47.21 37.15 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.588 0.588 . . . . 75.239999999999995 112.588 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 54.5 Cg_exo -54.76 -34.26 83.82 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.27 1.98 . . . . 75.510000000000005 111.988 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 46.5 ttp -81.66 -36.13 29.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.424 0.631 . . . . 74.420000000000002 109.966 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.7 -45.48 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.235 -0.893 . . . . 72.409999999999997 110.588 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -64.55 -15.07 60.36 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.055 -0.521 . . . . 55.310000000000002 111.676 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.9 m -83.82 -44.84 13.93 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.526 -0.546 . . . . 74.140000000000001 109.526 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -65.61 -42.05 92.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.747 -0.66 . . . . 75.030000000000001 110.48 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.26 -31.25 67.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.961 -0.563 . . . . 74.340000000000003 111.543 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.81 -36.1 83.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.114 0.483 . . . . 43.149999999999999 110.404 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -74.49 -8.92 57.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.742 . . . . 74.519999999999996 110.654 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.2 t -105.4 -9.84 17.32 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.022 -0.535 . . . . 62.030000000000001 110.305 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.63 38.72 4.89 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.78 -0.724 . . . . 65.150000000000006 112.588 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 mp -135.84 135.87 50.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.459 -0.571 . . . . 75.409999999999997 109.459 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.58 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 42.3 mt-30 -113.62 112.31 23.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.09 -0.337 . . . . 62.450000000000003 110.09 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 114' ' ' LEU . 20.9 mt -69.47 107.5 3.38 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 120.604 -0.438 . . . . 71.319999999999993 110.044 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.65 -114.72 0.17 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.901 -0.666 . . . . 73.409999999999997 112.171 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.464 ' HB2' ' HG3' ' A' ' 113' ' ' GLN . 21.9 mp0 -70.03 159.71 33.31 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.991 -0.374 . . . . 65.5 109.991 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 46.1 m -147.76 147.91 30.39 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.449 -0.341 . . . . 64.519999999999996 110.085 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.7 m -148.91 138.85 22.1 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.448 -0.342 . . . . 61.229999999999997 110.446 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 51.7 mt -141.56 96.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.386 -0.968 . . . . 52.5 108.386 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 8.6 t -141.04 159.66 41.74 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.411 0.624 . . . . 55.240000000000002 112.265 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.18 105.72 16.78 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.417 -0.811 . . . . 74.150000000000006 110.575 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.572 ' H ' HG13 ' A' ' 117' ' ' VAL . 37.2 mt-10 67.16 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.61 0.764 . . . . 73.239999999999995 111.647 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 23.3 t -96.57 164.61 12.53 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.278 -0.638 . . . . 73.319999999999993 109.278 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -78.52 124.89 28.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.951 -0.389 . . . . 72.120000000000005 109.951 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.98 121.97 26.69 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.304 -0.407 . . . . 63.350000000000001 110.768 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -106.89 -169.07 22.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 121.068 -0.587 . . . . 54.049999999999997 112.148 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -159.05 173.44 16.45 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 122.307 0.243 . . . . 71.430000000000007 110.458 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -158.51 153.03 24.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.869 -0.419 . . . . 61.240000000000002 109.869 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -149.64 169.58 20.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.944 -0.302 . . . . 74.349999999999994 111.181 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 10.9 p -158.97 166.39 31.9 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.145 -0.48 . . . . 71.129999999999995 110.739 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.1 p -170.92 139.56 1.46 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.436 -0.347 . . . . 44.219999999999999 110.251 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.9 p -138.31 176.96 8.24 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.519 -0.31 . . . . 74.349999999999994 110.813 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -150.16 170.68 18.37 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.212 -0.662 . . . . 70.409999999999997 109.212 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -159.77 97.64 1.31 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.654 -0.499 . . . . 72.129999999999995 109.654 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -100.89 162.32 12.98 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.815 -0.629 . . . . 51.310000000000002 109.362 178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.8 m -159.58 164.4 34.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.963 -0.384 . . . . 74.25 109.963 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 22.8 t -162.03 -169.39 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.859 -0.423 . . . . 72.019999999999996 109.859 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.567 -0.73 . . . . 63.109999999999999 110.197 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.4 m80 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 109.935 -0.395 . . . . 75.140000000000001 109.935 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.8 ptm -157.79 157.3 33.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.82 0.343 . . . . 55.100000000000001 111.195 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.21 86.64 0.06 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.411 -0.813 . . . . 71.299999999999997 109.403 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -79.24 91.39 4.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.985 -0.552 . . . . 73.040000000000006 112.037 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -83.47 -52.35 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.635 -0.505 . . . . 55.219999999999999 109.635 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 62.91 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.297 -0.865 . . . . 71.129999999999995 112.992 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.501 ' HG2' ' N ' ' A' ' 8' ' ' ALA . 38.6 ttt-85 -151.6 161.74 42.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.952 -0.567 . . . . 64.099999999999994 109.535 -175.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.501 ' N ' ' HG2' ' A' ' 7' ' ' ARG . . . -71.85 154.27 41.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.696 0.284 . . . . 74.329999999999998 110.464 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.7 t -91.93 156.82 17.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.45 -0.341 . . . . 71.299999999999997 110.751 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 169.86 -176.75 43.58 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.302 -0.719 . . . . 62.340000000000003 111.302 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.43 147.24 58.11 Favored 'Trans proline' 0 CA--C 1.517 -0.361 0 C-N-CA 122.641 2.227 . . . . 75.120000000000005 111.031 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.88 121.14 18.52 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.455 -0.339 . . . . 63.130000000000003 110.451 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.9 124.52 28.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.874 0.369 . . . . 61.509999999999998 110.355 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.2 m -81.33 123.61 81.2 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 73.150000000000006 110.349 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 176.98 7.43 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.804 2.336 . . . . 74.400000000000006 111.982 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.51 169.61 23.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.228 -0.442 . . . . 64.219999999999999 110.312 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -150.19 147.23 16.22 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.29 -0.633 . . . . 65.239999999999995 109.29 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.9 p -143.92 113.42 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.615 0.722 . . . . 64.5 111.362 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.77 -179.3 3.57 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 61.530000000000001 110.74 178.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -163.3 117.59 1.63 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.811 0.339 . . . . 65.040000000000006 111.118 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.6 162.93 28.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.002 -0.544 . . . . 44.399999999999999 110.806 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.11 174.42 10.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 71.230000000000004 110.523 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -153.99 165.57 35.74 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.117 -0.327 . . . . 73.219999999999999 110.117 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.4 m -73.98 167.1 22.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.812 0.339 . . . . 74.409999999999997 111.313 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.92 138.48 2.76 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.025 -0.534 . . . . 64.430000000000007 109.913 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -161.73 178.45 8.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.009 0.433 . . . . 71.409999999999997 110.991 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -146.28 133.21 14.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.187 -1.042 . . . . 63.43 108.187 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -151.61 27.67 0.64 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.984 0.421 . . . . 64.299999999999997 110.777 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.8 m -131.32 161.59 40.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.895 -0.593 . . . . 75.209999999999994 110.751 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.75 -170.81 3.31 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.858 -0.61 . . . . 73.409999999999997 109.462 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -79.02 145.76 66.28 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-O 120.7 0.286 . . . . 74.310000000000002 110.909 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.61 165.48 18.01 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.766 2.31 . . . . 62.420000000000002 111.236 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -49.51 114.1 1.2 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.735 2.29 . . . . 72.329999999999998 112.243 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.61 124.18 90.46 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.202 -0.453 . . . . 54.229999999999997 110.637 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -60.36 109.23 0.6 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.436 2.09 . . . . 73.540000000000006 111.629 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 19.6 m -86.02 148.96 4.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 73.319999999999993 110.604 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 34.6 p -87.88 -38.72 15.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.37 -0.377 . . . . 73.0 111.127 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -126.39 149.36 49.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.347 -0.388 . . . . 72.219999999999999 111.14 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.36 -78.14 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 111.441 -0.664 . . . . 75.519999999999996 111.441 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.29 18.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.78 0.324 . . . . 72.439999999999998 111.178 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.12 -24.55 59.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.998 0.428 . . . . 51.210000000000001 111.082 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -153.8 161.11 30.02 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 109.26 -0.645 . . . . 55.329999999999998 109.26 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -46.51 -57.25 2.36 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.808 2.339 . . . . 63.100000000000001 112.486 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER 63.58 178.18 0.16 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 116.097 -0.501 . . . . 65.019999999999996 110.62 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.565 ' H ' HG22 ' A' ' 44' ' ' THR . 61.0 tp -75.96 151.14 37.33 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.654 -0.499 . . . . 64.099999999999994 109.654 177.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t 71.74 -167.13 0.14 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 123.638 0.586 . . . . 72.400000000000006 109.769 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 m 67.85 113.76 0.04 OUTLIER 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.083 0.553 . . . . 75.530000000000001 110.968 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.78 -161.48 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.208 -0.451 . . . . 54.310000000000002 110.689 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.6 m 74.29 -57.31 0.62 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.618 0.767 . . . . 52.109999999999999 111.492 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.5 74.43 4.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.991 0.424 . . . . 53.329999999999998 110.124 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.414 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 19.7 mt-30 -90.38 140.91 27.07 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 75.319999999999993 110.6 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 21.4 Cg_exo -65.62 105.31 0.75 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.945 1.764 . . . . 72.030000000000001 110.018 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.8 mt -91.07 141.35 26.37 Favored Pre-proline 0 C--N 1.312 -1.044 0 CA-C-N 116.432 -0.349 . . . . 64.109999999999999 111.686 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.35 173.45 14.48 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.798 2.332 . . . . 70.120000000000005 111.474 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.4 m -82.8 160.35 3.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 120.734 0.302 . . . . 63.149999999999999 110.813 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.16 -165.09 0.36 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.998 -0.546 . . . . 65.420000000000002 110.324 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.1 t -72.49 169.75 15.78 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.258 -0.645 . . . . 72.209999999999994 109.258 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.38 129.16 92.22 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-O 120.376 0.131 . . . . 73.230000000000004 110.913 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.68 125.51 18.18 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.018 2.479 . . . . 54.020000000000003 112.612 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -87.25 163.48 2.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.605 -0.725 . . . . 75.109999999999999 110.503 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 tp -91.33 103.78 16.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.065 0.46 . . . . 72.129999999999995 110.658 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 m -122.37 74.48 1.18 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.667 0.746 . . . . 52.310000000000002 110.042 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.58 154.46 76.71 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 114.962 -1.017 . . . . 63.329999999999998 109.372 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.08 114.78 2.33 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.275 1.983 . . . . 74.239999999999995 111.229 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' NE1' ' A' ' 70' ' ' TRP . 5.5 mp -72.45 105.25 4.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.029 0.442 . . . . 63.340000000000003 110.336 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.31 -41.44 1.2 Allowed Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 110.881 -0.887 . . . . 75.010000000000005 110.881 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 m -60.79 147.19 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.024 -0.361 . . . . 62.310000000000002 110.024 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -61.46 -29.96 70.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.402 . . . . 71.25 110.186 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -57.72 -35.9 71.28 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.543 -0.753 . . . . 74.409999999999997 110.856 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.456 ' NE1' ' HG ' ' A' ' 65' ' ' LEU . 84.2 t90 -68.02 -43.59 78.44 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.545 -0.539 . . . . 71.120000000000005 109.545 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -58.06 -46.01 86.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.352 -0.386 . . . . 74.129999999999995 110.328 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 15.7 mm100 -53.1 -49.1 67.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.855 -0.611 . . . . 72.109999999999999 110.962 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 m -67.89 -44.25 77.45 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.852 -0.613 . . . . 73.150000000000006 110.73 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -56.66 -43.94 80.86 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.955 -0.566 . . . . 73.140000000000001 110.93 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.2 m -57.92 -45.62 86.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.698 -0.228 . . . . 74.219999999999999 111.291 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 13.2 mm100 -54.31 -52.0 62.88 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.325 -0.398 . . . . 62.109999999999999 111.962 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -61.52 -33.02 73.1 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 111.874 0.324 . . . . 74.140000000000001 111.874 -178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 91.7 t -78.89 -41.72 23.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.744 0.307 . . . . 65.430000000000007 110.674 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.565 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 93.6 mtp -63.68 -35.93 82.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.228 0.537 . . . . 72.510000000000005 109.588 177.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.547 ' HG ' ' NE2' ' A' ' 84' ' ' GLN . 61.8 tp -57.22 -43.35 82.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.499 -0.773 . . . . 74.510000000000005 110.739 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 20.0 m-85 -55.49 -55.9 26.48 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.778 0.288 . . . . 74.230000000000004 111.778 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 4.6 t -63.23 -30.06 71.28 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.489 -0.323 . . . . 71.439999999999998 111.706 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 79' ' ' MET . 71.3 mtp180 -71.53 -38.47 71.08 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.704 0.287 . . . . 63.210000000000001 111.117 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.547 ' NE2' ' HG ' ' A' ' 80' ' ' LEU . 48.6 mt-30 -73.44 -32.64 64.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.828 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 116.57 -9.9 16.71 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.52 -0.848 . . . . 53.43 112.038 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -81.44 -168.45 1.87 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.983 -0.377 . . . . 74.319999999999993 109.983 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.57 ' HB2' ' O ' ' A' ' 105' ' ' LEU . 25.6 pt20 -162.35 -35.86 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.662 0.268 . . . . 71.25 110.863 -177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.7 m -100.27 138.11 37.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.103 -0.702 . . . . 43.210000000000001 109.103 177.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.11 134.94 5.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.892 0.377 . . . . 74.150000000000006 111.582 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.416 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 1.1 mp0 -110.74 115.18 29.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.038 -0.727 . . . . 73.049999999999997 109.038 175.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 85.5 mt -114.7 159.14 20.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 116.567 -0.288 . . . . 74.219999999999999 110.264 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -85.34 157.15 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.27 -0.423 . . . . 75.519999999999996 110.742 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 147.73 39.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.569 -0.741 . . . . 64.140000000000001 110.834 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -112.28 132.82 21.93 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.176 -0.465 . . . . 74.200000000000003 110.487 175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.7 150.32 95.44 Favored 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 123.421 -1.491 . . . . 70.230000000000004 111.757 -0.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -68.48 21.67 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.006 1.113 . . . . 72.329999999999998 114.006 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 98' ' ' LEU . 11.3 pt-20 -56.94 -54.23 49.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.398 -0.521 . . . . 72.420000000000002 110.042 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 97' ' ' GLU . 19.2 mt -66.25 -25.46 66.9 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.232 0.539 . . . . 75.530000000000001 109.99 174.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.31 -45.28 2.8 Favored Glycine 0 N--CA 1.448 -0.504 0 CA-C-N 115.228 -0.896 . . . . 55.210000000000001 113.353 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -160.76 177.65 10.23 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.854 0.359 . . . . 74.430000000000007 111.005 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 82.9 t -134.53 134.3 54.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.498 -0.773 . . . . 72.310000000000002 109.13 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -103.46 101.25 11.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.638 0.256 . . . . 72.129999999999995 110.456 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.6 mt -97.93 115.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.935 -0.394 . . . . 61.219999999999999 109.935 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -121.05 85.26 2.37 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.025 0.441 . . . . 42.299999999999997 110.21 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 53.1 tp -88.55 115.63 26.21 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.01 -0.541 . . . . 71.150000000000006 110.307 177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -100.2 156.41 17.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.616 -0.72 . . . . 71.239999999999995 109.636 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 58.1 tp -133.27 135.38 44.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 120.938 0.399 . . . . 74.120000000000005 110.88 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.558 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . 25.1 t70 -147.66 133.76 19.33 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.218 -0.66 . . . . 65.120000000000005 109.218 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.7 t70 48.85 -91.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.299 0.64 . . . . 75.409999999999997 112.288 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -140.62 19.56 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.406 0.622 . . . . 70.25 109.824 179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.558 ' NE2' ' HB3' ' A' ' 108' ' ' ASP . 4.6 pp0? -130.86 137.53 49.41 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.522 -0.763 . . . . 75.420000000000002 109.687 -176.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -115.35 141.27 48.26 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.149 0.499 . . . . 51.149999999999999 112.297 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 55.5 tt0 -96.53 114.26 25.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.275 -0.875 . . . . 75.400000000000006 109.502 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -95.42 106.47 18.53 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.135 -0.484 . . . . 72.239999999999995 110.355 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.9 128.31 51.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.936 -0.574 . . . . 54.409999999999997 110.368 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 127' ' ' LEU . 55.2 mtm -138.3 144.23 40.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.991 0.424 . . . . 45.530000000000001 110.343 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.559 HG13 ' H ' ' A' ' 153' ' ' GLU . 5.1 t -122.03 121.41 64.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.705 -0.68 . . . . 74.540000000000006 110.644 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.4 p -158.76 146.19 13.29 Favored Pre-proline 0 C--N 1.314 -0.938 0 CA-C-N 115.695 -0.684 . . . . 61.340000000000003 109.383 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 124' ' ' ARG . 46.4 Cg_endo -67.19 172.84 9.4 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.867 2.378 . . . . 70.349999999999994 111.336 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -90.02 113.07 24.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.811 -0.756 . . . . 75.230000000000004 110.006 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -172.35 -169.83 0.66 Allowed 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.125 -0.943 . . . . 73.430000000000007 108.556 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -63.3 -27.44 69.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.718 -0.219 . . . . 74.0 111.49 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.01 -45.81 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-O 120.64 0.257 . . . . 73.450000000000003 110.503 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 119' ' ' PRO . 42.1 ttt-85 -63.37 -38.74 92.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.156 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.61 -50.66 71.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.696 -0.683 . . . . 74.5 110.065 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.23 91.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.452 -0.795 . . . . 63.539999999999999 111.855 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 116' ' ' MET . 3.9 mm? -63.92 -40.79 97.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.772 0.32 . . . . 74.409999999999997 111.21 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -69.72 -45.56 67.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.345 -0.389 . . . . 72.129999999999995 110.262 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.09 66.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.052 -0.522 . . . . 74.319999999999993 111.981 176.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.06 -13.32 60.48 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.593 0.59 . . . . 62.520000000000003 112.593 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 132' ' ' PRO . 93.1 mt -62.99 -54.04 50.04 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 112.728 0.64 . . . . 73.510000000000005 112.728 -177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 131' ' ' LEU . 18.8 Cg_endo -59.64 -24.97 77.48 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 122.164 1.909 . . . . 42.520000000000003 112.466 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.568 ' O ' HG22 ' A' ' 136' ' ' THR . 2.0 tmm? -81.36 -39.28 25.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.502 0.668 . . . . 74.040000000000006 109.467 179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.76 -44.68 73.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.257 -0.883 . . . . 64.310000000000002 111.19 -178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -53.39 -36.95 62.01 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.844 -0.616 . . . . 74.209999999999994 112.528 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 133' ' ' MET . 11.0 t -74.1 -31.3 62.74 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.481 -0.488 . . . . 73.239999999999995 111.064 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 133' ' ' MET . 62.3 mm-40 -70.66 -46.87 62.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.233 0.539 . . . . 73.109999999999999 110.06 178.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.401 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 4.6 mm? -68.63 -26.44 65.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 63.439999999999998 111.149 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.11 73.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.214 -0.448 . . . . 64.299999999999997 111.016 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -67.09 -22.37 65.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 61.32 111.326 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 75.6 m -98.83 2.83 47.13 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.332 -0.395 . . . . 70.219999999999999 111.579 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 84.82 45.82 5.89 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.408 -0.901 . . . . 61.229999999999997 112.208 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.401 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 3.2 mp -134.74 133.99 54.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.151 -0.685 . . . . 73.319999999999993 109.151 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 46.3 mt-30 -128.79 117.78 21.67 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.124 -0.324 . . . . 71.239999999999995 110.124 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 88.2 mt -71.21 106.0 3.64 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.096 0.474 . . . . 74.340000000000003 110.656 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -93.92 -56.37 1.41 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 110.924 -0.87 . . . . 65.150000000000006 110.924 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 47.7 mt-30 -104.63 138.85 40.35 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 110.173 -0.306 . . . . 51.5 110.173 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 40.4 m -144.1 143.13 31.0 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.719 -0.475 . . . . 61.329999999999998 109.719 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 17.3 m -143.88 136.96 27.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 120.59 0.233 . . . . 65.030000000000001 110.591 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 62.5 mt -135.36 100.19 2.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.185 -0.672 . . . . 75.209999999999994 109.185 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 62.2 m -119.63 155.43 32.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.222 -0.444 . . . . 64.329999999999998 111.582 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 4.8 p -87.39 60.19 5.93 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.941 -0.572 . . . . 72.25 109.712 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.559 ' H ' HG13 ' A' ' 117' ' ' VAL . 42.3 mt-10 69.97 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.218 -0.901 . . . . 74.230000000000004 109.519 -176.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 52.2 m -156.43 25.47 0.35 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.112 -0.699 . . . . 64.019999999999996 109.112 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -78.75 110.76 14.21 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.37 -0.832 . . . . 74.310000000000002 111.624 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.61 98.09 11.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.842 -0.617 . . . . 73.230000000000004 110.051 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -98.51 134.02 11.54 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.394 -0.908 . . . . 63.130000000000003 111.791 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -153.5 105.56 2.84 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 122.476 0.311 . . . . 54.409999999999997 110.258 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -77.17 135.41 38.52 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.212 -0.662 . . . . 75.329999999999998 109.212 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -141.51 153.53 44.96 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.805 0.336 . . . . 71.230000000000004 110.767 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 25.1 m -144.58 -51.08 0.28 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.939 -0.573 . . . . 70.140000000000001 110.719 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 13.2 m 66.44 30.73 8.58 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.374 0.607 . . . . 64.540000000000006 110.518 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.6 m -85.64 146.19 26.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.661 -0.7 . . . . 62.229999999999997 110.743 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -146.78 -169.94 3.41 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.285 -0.635 . . . . 73.140000000000001 109.285 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -159.86 116.44 2.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.196 0.522 . . . . 74.040000000000006 111.225 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -99.3 165.61 11.6 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.383 -0.969 . . . . 63.009999999999998 108.383 176.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 61.2 m -157.71 114.15 2.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.227 0.537 . . . . 63.149999999999999 110.821 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 4.3 p -161.74 129.61 4.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.449 -0.796 . . . . 50.200000000000003 110.299 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.457 -0.782 . . . . 70.129999999999995 110.246 179.296 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.8 t60 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.834 0.349 . . . . 75.200000000000003 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -89.98 -162.82 0.93 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.209 -0.45 . . . . 65.099999999999994 110.118 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.04 114.34 0.69 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 63.130000000000003 110.271 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.1 m -158.14 126.05 5.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.172 -0.467 . . . . 72.439999999999998 110.322 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.613 ' OD1' ' HB2' ' A' ' 7' ' ' ARG . 16.3 t70 -82.11 -51.4 8.02 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.987 -0.551 . . . . 64.310000000000002 110.041 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 64.31 25.58 13.51 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.631 0.974 . . . . 73.120000000000005 113.631 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.613 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 71.3 ttt180 -69.97 155.04 41.16 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.89 -0.324 . . . . 63.43 110.482 178.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.71 47.28 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.252 0.549 . . . . 71.099999999999994 110.061 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -86.08 88.24 7.55 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.668 -0.696 . . . . 62.409999999999997 110.435 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.01 -159.09 11.15 Favored Glycine 0 N--CA 1.442 -0.94 0 C-N-CA 120.66 -0.781 . . . . 43.039999999999999 112.085 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -83.31 173.01 10.12 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.744 2.296 . . . . 34.450000000000003 111.852 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 133.07 2.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.471 -0.331 . . . . 73.099999999999994 110.854 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 85.3 mt -82.68 141.13 32.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.415 -0.357 . . . . 75.109999999999999 110.046 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.3 m -86.63 119.43 71.32 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 116.549 -0.296 . . . . 61.520000000000003 110.798 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.71 143.67 18.93 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.361 2.041 . . . . 63.119999999999997 110.974 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.84 154.1 23.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.758 0.313 . . . . 72.340000000000003 110.448 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -146.12 141.27 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 73.010000000000005 109.745 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -84.19 115.32 26.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 109.861 -0.422 . . . . 54.310000000000002 109.861 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -166.55 97.56 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 63.409999999999997 110.536 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.3 -53.51 10.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.13 -0.486 . . . . 64.329999999999998 110.708 179.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.6 142.87 3.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.866 -0.606 . . . . 61.530000000000001 110.11 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -165.44 115.82 1.07 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 120.972 0.415 . . . . 52.210000000000001 110.799 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -152.3 36.09 0.52 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.607 0.718 . . . . 73.120000000000005 109.231 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.1 m -72.56 94.13 1.66 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 110.566 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.61 75.42 0.18 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.855 -0.612 . . . . 63.43 110.208 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -160.71 113.65 2.01 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.019 -0.734 . . . . 70.230000000000004 109.019 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 m -84.51 144.76 9.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.799 0.333 . . . . 64.329999999999998 111.044 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -149.17 90.06 1.71 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.075 -0.511 . . . . 75.230000000000004 110.792 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.4 p -113.55 -2.23 10.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.261 0.553 . . . . 75.219999999999999 109.614 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 70.34 154.97 0.13 Allowed 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.066 -0.97 . . . . 74.019999999999996 111.32 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t 71.65 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.541 -0.754 . . . . 72.540000000000006 111.065 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.37 159.04 44.01 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.858 2.372 . . . . 74.519999999999996 111.726 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -58.14 126.05 20.39 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.688 2.259 . . . . 63.520000000000003 112.101 179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 35' ' ' PRO . . . -69.57 129.73 91.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 53.549999999999997 110.675 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 34' ' ' ALA . 28.9 Cg_exo -62.59 140.44 81.31 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.655 2.237 . . . . 62.240000000000002 112.274 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.7 t -140.73 133.3 31.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.948 -0.76 . . . . 44.43 108.948 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.1 m -88.67 134.51 33.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.488 -0.324 . . . . 75.319999999999993 111.113 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -64.98 156.39 31.42 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.249 -0.432 . . . . 71.519999999999996 110.636 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.75 -119.71 4.51 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.962 -0.637 . . . . 50.539999999999999 111.521 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -167.5 -68.24 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 122.264 0.226 . . . . 71.400000000000006 110.402 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 46.82 68.75 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.732 0.645 . . . . 75.519999999999996 111.416 -178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mtp -150.87 99.81 3.1 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.982 -0.554 . . . . 71.400000000000006 110.603 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -63.48 97.05 0.2 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.266 1.978 . . . . 64.129999999999995 110.009 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 m -89.31 124.62 34.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.827 -0.624 . . . . 63.539999999999999 111.883 -175.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 62.7 tp -82.89 140.09 33.05 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.084 -0.71 . . . . 75.129999999999995 109.084 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m -70.45 83.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.36 0.6 . . . . 63.149999999999999 110.743 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.3 t -154.48 113.79 3.71 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.302 -0.863 . . . . 73.349999999999994 109.302 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.07 152.6 19.23 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.79 -0.641 . . . . 74.140000000000001 109.829 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 2.0 t -148.14 96.19 2.59 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.682 0.753 . . . . 72.450000000000003 110.259 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.42 175.98 9.46 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.065 -0.97 . . . . 75.219999999999999 108.825 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.55 117.78 69.39 Favored Pre-proline 0 C--N 1.311 -1.082 0 C-N-CA 120.886 -0.325 . . . . 75.0 110.187 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.67 126.96 13.3 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.272 2.648 . . . . 74.239999999999995 112.21 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.7 mt -96.37 114.09 63.7 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 115.89 -0.596 . . . . 75.540000000000006 110.677 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.52 147.93 92.8 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.357 2.038 . . . . 71.120000000000005 110.724 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.431 ' O ' HD11 ' A' ' 80' ' ' LEU . 14.2 m -143.23 132.75 21.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.944 0.402 . . . . 75.430000000000007 110.891 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -45.6 58.07 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.744 -0.662 . . . . 63.350000000000001 110.321 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.2 m -80.2 104.25 10.63 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.816 -0.629 . . . . 72.209999999999994 110.862 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 124.34 90.74 Favored Pre-proline 0 C--O 1.239 0.521 0 CA-C-N 115.899 -0.592 . . . . 51.340000000000003 110.813 179.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.13 177.11 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.418 2.079 . . . . 64.120000000000005 111.624 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.8 m -86.14 159.82 3.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.301 -0.409 . . . . 64.099999999999994 109.991 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.5 tp -91.52 87.99 6.6 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.476 0.655 . . . . 74.340000000000003 110.895 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.6 m -107.31 74.0 0.95 Allowed 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.41 -0.813 . . . . 74.439999999999998 110.192 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.9 156.57 75.82 Favored Pre-proline 0 C--N 1.312 -1.053 0 CA-C-N 115.627 -0.715 . . . . 74.219999999999999 109.55 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.89 131.75 41.25 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.115 1.876 . . . . 74.209999999999994 111.148 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.64 HD23 ' H ' ' A' ' 65' ' ' LEU . 1.3 pt? -67.7 136.31 54.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.95 0.405 . . . . 65.420000000000002 110.569 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.07 -31.06 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.828 -0.701 . . . . 55.43 111.672 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.4 t -59.97 146.04 43.97 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 122.643 0.377 . . . . 55.32 111.208 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -70.03 -29.07 66.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 109.082 -0.711 . . . . 73.120000000000005 109.082 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.08 -39.72 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.752 -0.658 . . . . 75.420000000000002 109.936 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.9 t90 -64.53 -41.77 96.18 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.472 -0.785 . . . . 74.329999999999998 109.435 178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -66.51 -47.2 73.72 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.768 -0.651 . . . . 74.530000000000001 110.294 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -57.67 -46.03 84.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.96 -0.564 . . . . 74.349999999999994 112.02 177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 24.8 m -65.11 -38.46 90.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.812 -0.44 . . . . 55.25 109.812 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.668 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.1 t80 -56.3 -45.43 80.23 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.124 -0.489 . . . . 74.040000000000006 110.074 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.2 m -61.96 -37.42 84.67 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.702 0.287 . . . . 72.530000000000001 110.825 177.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 73' ' ' THR . 77.4 mm-40 -52.84 -46.95 68.04 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.008 -0.542 . . . . 74.109999999999999 112.247 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 2.4 pt20 -61.12 -25.83 67.25 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.953 0.406 . . . . 72.099999999999994 111.284 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 39.1 t -77.82 -21.69 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-O 121.241 0.543 . . . . 70.120000000000005 110.01 -177.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 26.3 mmt -69.49 -21.85 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.876 -0.602 . . . . 72.540000000000006 109.385 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.541 HD13 ' HD3' ' A' ' 83' ' ' ARG . 3.2 mm? -85.74 -37.7 19.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.709 -0.678 . . . . 75.420000000000002 110.007 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 19.8 m-30 -50.56 -54.31 23.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.925 -0.579 . . . . 74.140000000000001 111.157 176.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.7 t -63.61 -23.6 67.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 120.928 0.394 . . . . 70.049999999999997 111.806 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' HD13 ' A' ' 80' ' ' LEU . 44.6 mtp180 -74.41 -67.84 0.59 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.023 0.44 . . . . 73.319999999999993 111.753 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -82.15 -2.6 52.67 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.562 0.578 . . . . 74.430000000000007 112.562 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.93 36.91 65.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.244 -0.979 . . . . 54.149999999999999 111.247 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -81.01 87.0 6.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.268 0.556 . . . . 65.310000000000002 110.619 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 20.6 pt20 -72.84 -6.38 44.52 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.473 -0.785 . . . . 61.350000000000001 112.995 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.8 p -147.55 137.08 22.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 110.153 -0.314 . . . . 62.100000000000001 110.153 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.15 151.51 28.33 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 111.666 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -111.29 117.45 33.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.62 -0.718 . . . . 74.400000000000006 109.115 176.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 77' ' ' GLN . 55.5 tp -103.68 126.81 51.06 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.752 0.31 . . . . 64.219999999999999 111.4 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -81.8 155.38 25.46 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.042 -0.725 . . . . 62.420000000000002 109.042 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 66.7 mt -141.0 153.85 45.75 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.947 0.403 . . . . 74.040000000000006 111.781 -176.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 8.5 m-70 -119.72 126.27 27.01 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.404 -0.816 . . . . 75.239999999999995 109.668 173.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 58.7 Cg_endo -72.21 147.36 88.58 Favored 'Cis proline' 0 C--O 1.233 0.263 0 C-N-CA 123.083 -1.632 . . . . 71.420000000000002 111.811 2.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 96' ' ' GLU . 1.0 OUTLIER -72.07 21.37 0.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.868 1.062 . . . . 72.010000000000005 113.868 -177.199 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 98' ' ' LEU . 9.3 pt-20 -57.69 -53.55 56.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.435 -0.58 . . . . 75.140000000000001 109.435 174.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -61.83 -32.12 72.42 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.477 -0.564 . . . . 73.140000000000001 109.477 173.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.17 -44.87 0.33 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 116.091 1.197 . . . . 73.030000000000001 116.091 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.71 157.5 39.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 117.807 0.804 . . . . 74.109999999999999 112.549 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.3 t -134.66 130.55 53.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.74 -1.118 . . . . 43.25 108.258 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.555 ' HB2' ' HB ' ' A' ' 117' ' ' VAL . 72.0 m80 -102.16 103.57 14.11 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.99 -0.374 . . . . 73.239999999999995 109.99 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.75 117.13 36.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-O 120.847 0.356 . . . . 71.540000000000006 111.021 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 5.8 m -93.43 165.29 12.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.704 -0.85 . . . . 65.040000000000006 108.704 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 54.3 tp -151.68 107.43 3.37 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.612 -0.435 . . . . 64.5 111.516 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 99.7 mttt -98.92 129.43 45.25 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.876 -0.787 . . . . 60.030000000000001 108.876 175.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 63.7 tp -132.4 132.59 42.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.098 0.475 . . . . 62.340000000000003 111.528 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 111' ' ' GLN . 22.4 t70 -139.12 120.92 15.4 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.217 -1.031 . . . . 64.349999999999994 108.217 177.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.4 t70 47.88 -78.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.212 0.819 . . . . 61.520000000000003 113.212 -174.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -147.27 23.19 1.17 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.802 0.441 . . . . 71.0 110.744 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 29.8 pt20 -123.59 127.29 48.06 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.444 -0.947 . . . . 65.219999999999999 108.444 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 145' ' ' LEU . . . -132.28 141.94 49.18 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.044 0.449 . . . . 70.439999999999998 112.172 -176.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.406 ' NE2' ' HD2' ' A' ' 106' ' ' LYS . 8.1 tt0 -102.52 119.4 38.76 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.676 -0.693 . . . . 72.129999999999995 109.354 174.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.17 111.31 23.02 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.001 -0.74 . . . . 62.399999999999999 109.001 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.489 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 18.6 mt-30 -100.57 143.73 30.39 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.993 -0.548 . . . . 75.230000000000004 110.57 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 55.4 mtt -128.9 111.09 12.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 116.169 -0.469 . . . . 72.099999999999994 110.096 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 151' ' ' SER . 61.0 t -104.56 115.08 45.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.854 -0.424 . . . . 72.530000000000001 109.854 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 152' ' ' SER . 13.7 p -163.72 149.43 9.43 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.655 -0.702 . . . . 73.219999999999999 110.0 -176.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.55 159.79 10.37 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.537 2.158 . . . . 73.099999999999994 111.596 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -86.53 124.47 32.87 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.161 -0.616 . . . . 73.519999999999996 110.483 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.7 p -165.23 -173.53 2.89 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.015 -0.993 . . . . 74.430000000000007 108.505 -178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -68.46 -18.61 64.45 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.532 -0.467 . . . . 70.439999999999998 110.914 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.58 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.94 -34.84 75.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.818 -0.628 . . . . 51.039999999999999 110.258 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.92 -38.79 89.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 109.886 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.68 75.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.469 -0.787 . . . . 51.030000000000001 111.277 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 127' ' ' LEU . 1.2 mm? -64.94 -48.73 73.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.738 -0.385 . . . . 73.219999999999999 110.347 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.41 -47.79 84.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.565 . . . . 74.019999999999996 110.19 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.59 -26.04 65.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.169 -0.468 . . . . 61.299999999999997 111.972 177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -79.02 -15.23 58.53 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.145 0.424 . . . . 61.030000000000001 112.145 -178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.496 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 93.4 mt -56.33 -52.48 72.79 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 113.267 0.84 . . . . 73.099999999999994 113.267 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 131' ' ' LEU . 72.4 Cg_exo -51.03 -64.5 0.2 Allowed 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.204 1.936 . . . . 62.229999999999997 112.192 179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 35.9 ttp -52.51 -45.5 66.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 63.210000000000001 111.667 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.45 -60.75 2.98 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.755 0.312 . . . . 71.109999999999999 111.17 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 5.0 ppt_? -58.66 -27.92 65.23 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.347 -0.388 . . . . 74.400000000000006 111.758 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 23.0 m -72.23 -39.84 68.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.763 -0.375 . . . . 74.209999999999994 110.428 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 133' ' ' MET . 30.1 mm-40 -65.39 -43.73 89.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.99 0.424 . . . . 70.040000000000006 110.176 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 145' ' ' LEU . 9.8 mp -70.74 -29.28 65.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 74.109999999999999 111.155 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.1 -34.26 77.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.089 0.471 . . . . 73.0 110.295 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -77.53 -13.32 59.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.642 -0.708 . . . . 75.040000000000006 110.763 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -98.01 -15.61 19.99 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.072 -0.513 . . . . 71.519999999999996 110.354 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 104.02 33.38 4.05 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.699 -0.762 . . . . 64.140000000000001 112.865 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.5 mp -132.78 129.03 57.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.959 -0.756 . . . . 61.420000000000002 108.959 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -105.48 108.68 20.32 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.017 0.377 . . . . 54.240000000000002 112.017 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.6 mt -89.18 97.89 11.46 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.069 -0.715 . . . . 70.340000000000003 109.069 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -85.26 -55.79 2.54 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.434 -0.889 . . . . 54.210000000000001 111.997 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -103.62 153.98 20.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 120.924 0.392 . . . . 73.409999999999997 110.064 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.7 m -143.03 150.19 39.26 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.733 -0.84 . . . . 72.120000000000005 108.733 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 22.6 t -139.97 133.58 30.3 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.803 -0.359 . . . . 71.25 110.237 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.3 mt -130.62 120.38 48.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.16 -0.682 . . . . 75.519999999999996 109.16 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 14.4 m -146.22 156.64 43.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.608 -0.269 . . . . 73.430000000000007 111.017 -177.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 118' ' ' SER . 16.0 p -84.25 -40.52 17.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.591 -0.892 . . . . 70.430000000000007 108.591 175.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -143.06 -46.24 0.3 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.265 -1.334 . . . . 72.140000000000001 108.293 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.9 t -160.96 134.85 6.88 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.253 -1.017 . . . . 62.240000000000002 108.253 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -90.2 103.41 16.09 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.818 0.342 . . . . 75.329999999999998 110.162 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -157.88 113.61 2.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.052 -0.522 . . . . 73.530000000000001 110.206 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 166.42 124.86 0.74 Allowed Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.718 -0.754 . . . . 75.540000000000006 111.636 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -78.5 -177.6 5.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.06 0.457 . . . . 33.310000000000002 111.245 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -156.04 102.18 2.13 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.757 -0.656 . . . . 71.319999999999993 109.495 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -85.31 133.9 34.13 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.758 -0.656 . . . . 73.010000000000005 110.534 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -114.09 168.04 10.16 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 109.788 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 16.5 p -163.68 117.79 1.55 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.181 0.515 . . . . 73.400000000000006 110.117 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 8.8 t -131.57 -179.31 5.3 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.814 -0.63 . . . . 75.530000000000001 109.509 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -154.64 151.17 28.47 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.045 -0.724 . . . . 61.299999999999997 109.045 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -150.06 127.51 11.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.861 0.362 . . . . 75.439999999999998 110.296 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -92.76 175.6 6.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.198 -0.455 . . . . 63.350000000000001 110.112 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.0 p -168.12 140.91 3.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.706 0.289 . . . . 63.039999999999999 110.5 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 24.4 m -156.24 -19.07 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.37 -0.377 . . . . 51.109999999999999 111.133 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.84 -0.6 . . . . 54.439999999999998 110.043 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.861 0.362 . . . . 73.030000000000001 110.917 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.9 mmt -75.96 167.39 21.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 109.921 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.13 -162.52 0.42 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.325 -0.398 . . . . 60.310000000000002 110.121 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m -155.9 21.79 0.38 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.098 0.475 . . . . 72.329999999999998 110.257 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -77.79 -42.42 33.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 64.5 109.883 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.0 t70 59.61 100.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.309 -0.86 . . . . 64.239999999999995 112.533 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -100.48 103.37 14.72 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.201 -0.666 . . . . 72.230000000000004 109.201 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.35 127.79 3.88 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.913 -0.585 . . . . 64.340000000000003 109.983 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.1 m -91.2 120.8 32.43 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.074 -0.512 . . . . 74.340000000000003 110.729 -178.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -164.51 76.17 0.16 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.968 -0.634 . . . . 72.340000000000003 111.595 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -83.94 139.8 8.68 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.708 2.272 . . . . 62.340000000000003 112.694 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.83 155.1 37.92 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.792 -0.64 . . . . 70.409999999999997 109.466 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -147.7 97.77 2.87 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.253 0.549 . . . . 74.219999999999999 109.763 -178.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 40.4 m -85.89 130.4 50.66 Favored Pre-proline 0 C--N 1.313 -0.98 0 CA-C-N 115.34 -0.845 . . . . 71.0 109.332 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -56.65 121.64 10.4 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.735 2.29 . . . . 74.409999999999997 112.009 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 tp -76.37 131.43 39.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.038 -0.528 . . . . 63.109999999999999 110.996 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.83 129.03 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-N 115.919 -0.582 . . . . 54.119999999999997 109.773 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 p -147.9 124.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.246 0.546 . . . . 72.450000000000003 111.035 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.29 178.36 3.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.588 -0.733 . . . . 72.420000000000002 111.26 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.52 108.59 1.22 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.139 -0.482 . . . . 72.519999999999996 110.27 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -168.31 -178.63 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.349 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.77 134.36 5.14 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.71 -0.478 . . . . 61.329999999999998 109.71 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 m -81.58 101.9 10.28 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.151 -0.477 . . . . 74.299999999999997 111.045 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -75.07 168.34 20.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.011 -0.54 . . . . 74.129999999999995 110.068 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -167.29 104.8 0.54 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.489 -0.323 . . . . 61.43 110.623 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -79.47 73.37 6.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.241 0.543 . . . . 53.439999999999998 110.27 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.6 p -156.21 90.45 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.347 -0.842 . . . . 61.329999999999998 109.877 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -159.9 94.9 1.15 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.643 -0.708 . . . . 71.400000000000006 109.957 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.9 m -94.67 142.43 13.49 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 115.986 -0.552 . . . . 62.0 111.139 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.17 121.8 24.82 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.865 -0.607 . . . . 55.409999999999997 109.895 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 p -151.79 101.51 2.88 Favored Pre-proline 0 C--N 1.313 -1.014 0 CA-C-O 121.051 0.453 . . . . 30.300000000000001 111.049 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -85.44 154.13 10.59 Favored 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.801 2.334 . . . . 74.340000000000003 111.705 178.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.49 140.81 30.52 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.371 2.048 . . . . 74.299999999999997 111.586 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.21 126.15 89.36 Favored Pre-proline 0 C--N 1.316 -0.854 0 CA-C-N 116.08 -0.509 . . . . 73.150000000000006 110.211 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.03 122.23 10.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.709 2.273 . . . . 44.299999999999997 111.091 178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.1 t 62.31 80.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.816 -0.629 . . . . 73.310000000000002 109.91 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 t -83.15 -19.94 35.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.986 -0.552 . . . . 72.120000000000005 110.404 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -125.46 111.02 14.61 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.539 -0.541 . . . . 75.340000000000003 109.539 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.23 102.34 0.83 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.669 -0.777 . . . . 53.100000000000001 111.791 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.1 13.73 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.857 0.361 . . . . 71.109999999999999 110.495 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -164.26 163.37 22.71 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.82 -0.807 . . . . 42.109999999999999 108.82 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -154.79 134.34 7.77 Favored Pre-proline 0 C--N 1.311 -1.101 0 C-N-CA 120.774 -0.37 . . . . 74.299999999999997 110.982 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -64.05 108.32 0.93 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.208 1.939 . . . . 60.240000000000002 110.411 177.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.3 m -81.28 78.81 8.03 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.562 0.696 . . . . 74.430000000000007 110.696 -177.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.3 tt -86.18 107.45 17.89 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.066 -0.97 . . . . 73.519999999999996 109.109 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 m -71.23 104.31 3.07 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 110.056 -0.35 . . . . 74.239999999999995 110.056 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.4 m -75.49 85.19 2.58 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.06 0.457 . . . . 53.109999999999999 111.128 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.37 139.84 4.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.561 -0.745 . . . . 74.040000000000006 109.924 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.6 m -147.0 26.56 1.09 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.932 0.872 . . . . 74.420000000000002 109.072 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.91 -160.61 0.64 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.837 -1.074 . . . . 74.439999999999998 108.594 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -75.58 148.4 82.77 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 120.601 -0.44 . . . . 65.030000000000001 110.5 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.34 138.1 55.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.161 2.574 . . . . 65.340000000000003 112.614 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.52 144.77 96.68 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.827 -0.624 . . . . 44.25 110.483 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.74 123.26 13.42 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.982 2.455 . . . . 74.150000000000006 112.4 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.8 m -83.58 28.01 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-N 115.817 -0.629 . . . . 63.240000000000002 111.65 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -163.13 152.6 15.18 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.022 -0.535 . . . . 51.310000000000002 109.652 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.7 m 63.64 32.59 13.8 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 123.66 0.6 . . . . 75.409999999999997 110.416 -178.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.8 141.1 92.13 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.37 -0.832 . . . . 63.32 110.476 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.42 174.71 10.46 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.471 2.114 . . . . 63.5 112.144 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 92' ' ' ARG . 27.9 m -83.91 -175.66 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 116.153 -0.476 . . . . 74.019999999999996 110.572 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.3 tp -87.65 96.12 10.31 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.032 0.444 . . . . 74.230000000000004 110.532 -178.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.2 m -133.16 77.2 1.72 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.446 0.641 . . . . 62.219999999999999 110.178 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.15 158.13 74.31 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 115.144 -0.935 . . . . 62.509999999999998 109.23 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 70' ' ' TRP . 10.3 Cg_endo -52.36 115.15 2.01 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.464 2.109 . . . . 72.209999999999994 110.969 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 65' ' ' LEU . 2.5 pp -67.54 134.09 50.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.354 0.597 . . . . 72.430000000000007 111.823 -175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.78 -34.82 4.9 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.544 -0.753 . . . . 61.049999999999997 111.253 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 t -61.35 156.42 19.01 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 122.785 0.434 . . . . 72.209999999999994 111.043 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.37 -27.71 68.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.431 -0.581 . . . . 75.129999999999995 109.431 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.78 -42.34 93.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.717 -0.674 . . . . 63.140000000000001 110.014 177.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 81.1 t90 -69.21 -41.38 77.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.679 -0.692 . . . . 73.0 110.014 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -59.85 -50.41 73.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.97 -0.559 . . . . 75.230000000000004 110.954 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 54.5 mt-30 -62.9 -38.05 89.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.135 -0.484 . . . . 64.120000000000005 111.974 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 59.0 m -66.15 -42.77 88.59 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.046 -0.353 . . . . 75.019999999999996 110.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 78' ' ' VAL . 85.2 t80 -58.34 -40.53 82.37 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.192 -0.458 . . . . 71.409999999999997 110.218 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 m -57.75 -44.72 86.29 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.525 -0.307 . . . . 75.540000000000006 111.05 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 15.7 mm-40 -55.32 -52.54 63.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.132 -0.485 . . . . 71.129999999999995 111.286 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.552 HE22 HD21 ' A' ' 93' ' ' LEU . 4.3 pt20 -64.39 -21.33 66.6 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.387 0.514 . . . . 73.099999999999994 112.387 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 74' ' ' PHE . 98.7 t -82.07 -31.94 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.123 0.487 . . . . 51.439999999999998 109.973 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 85.1 mtp -68.69 -22.92 64.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.202 0.525 . . . . 74.439999999999998 109.735 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.04 -40.93 82.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.476 -0.784 . . . . 73.25 109.403 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 34.2 m-85 -52.4 -54.92 25.72 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.582 -0.735 . . . . 74.129999999999995 112.083 177.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.0 t -68.45 -21.91 64.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.772 0.32 . . . . 65.510000000000005 111.544 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 79' ' ' MET . 36.5 mmt180 -71.93 -51.67 20.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.93 0.395 . . . . 71.0 110.792 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.24 -24.63 34.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.102 -0.499 . . . . 52.109999999999999 111.696 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 90.84 39.49 5.81 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.066 -0.814 . . . . 62.240000000000002 111.066 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -81.92 -174.46 5.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.412 0.625 . . . . 43.219999999999999 111.935 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -155.57 -23.43 0.11 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.039 -0.982 . . . . 73.230000000000004 110.69 178.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 47.7 m -150.96 140.11 21.17 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.212 -0.662 . . . . 52.109999999999999 109.212 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.61 156.07 22.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.893 0.377 . . . . 75.209999999999994 111.183 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -133.67 128.32 34.77 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.442 -0.799 . . . . 73.109999999999999 109.406 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 16.8 tp -130.93 168.45 17.31 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.396 -0.594 . . . . 74.310000000000002 109.396 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.435 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 1.6 tmt_? -79.09 96.19 5.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.847 0.832 . . . . 53.240000000000002 109.039 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.552 HD21 HE22 ' A' ' 77' ' ' GLN . 14.5 mt -101.7 172.12 7.14 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.509 -1.223 . . . . 53.200000000000003 112.036 -177.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.492 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 26.4 m80 -124.25 159.28 57.84 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.288 -0.869 . . . . 75.120000000000005 109.257 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 28.2 Cg_endo -61.62 167.44 28.46 Favored 'Cis proline' 0 C--N 1.351 0.702 0 C-N-CA 124.414 -1.078 . . . . 61.350000000000001 114.083 2.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.4 -39.46 87.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.826 -1.079 . . . . 64.430000000000007 110.039 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -39.12 -50.31 1.85 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 71.239999999999995 111.924 174.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.07 -39.57 86.52 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.105 0.409 . . . . 65.340000000000003 112.105 -179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.62 -44.9 0.15 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 115.36 0.904 . . . . 43.329999999999998 115.36 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -153.05 155.65 37.27 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 117.103 0.451 . . . . 73.120000000000005 110.139 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.419 ' HB ' HD12 ' A' ' 93' ' ' LEU . 71.1 t -144.61 140.48 23.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.468 -0.568 . . . . 64.450000000000003 109.468 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -110.51 109.7 20.15 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.286 -0.635 . . . . 70.340000000000003 109.286 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 88' ' ' SER . 4.9 mp -97.01 126.08 49.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 CA-C-N 116.5 -0.318 . . . . 63.210000000000001 110.546 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 11.5 t -100.87 166.39 10.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.152 -0.685 . . . . 64.439999999999998 109.152 178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 87' ' ' GLN . 63.7 tp -152.31 113.55 4.26 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.532 0.206 . . . . 60.210000000000001 110.616 -176.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 39.7 ttmt -115.55 140.06 49.5 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.648 -0.501 . . . . 74.219999999999999 109.648 177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 56.2 tp -134.56 106.39 6.98 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 109.87 -0.419 . . . . 70.540000000000006 109.87 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -111.94 131.43 55.39 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.846 -0.798 . . . . 54.399999999999999 108.846 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.9 t70 51.09 -84.65 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 O-C-N 124.045 0.84 . . . . 61.520000000000003 112.323 -176.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -148.9 31.5 0.78 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.51 0.671 . . . . 64.430000000000007 109.878 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -135.18 136.97 42.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 74.219999999999999 109.442 179.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -109.18 134.76 51.31 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.015 0.436 . . . . 70.340000000000003 111.872 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 147' ' ' GLN . 57.9 tt0 -108.3 114.49 28.39 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.457 -0.792 . . . . 65.010000000000005 109.872 176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 4.2 mm? -94.53 139.73 30.77 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 116.173 -0.467 . . . . 63.5 110.655 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' O ' ' A' ' 149' ' ' SER . 38.3 mt-30 -143.98 140.21 29.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.59 -0.732 . . . . 73.310000000000002 109.61 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.477 ' HE1' ' HB3' ' A' ' 114' ' ' LEU . 2.5 mpt? -136.76 150.54 48.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.885 -0.413 . . . . 70.430000000000007 109.885 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.435 HG13 ' HA ' ' A' ' 153' ' ' GLU . 72.1 t -106.61 108.52 25.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.442 -0.345 . . . . 63.149999999999999 110.322 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 152' ' ' SER . 26.8 p -161.22 143.12 8.96 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.467 -0.333 . . . . 61.32 110.396 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.12 174.82 0.29 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 123.326 2.684 . . . . 53.329999999999998 112.767 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -85.99 117.31 24.75 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.548 -0.538 . . . . 73.340000000000003 109.548 -177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.2 p -157.34 170.44 22.46 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.946 -0.57 . . . . 63.310000000000002 110.78 -176.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -66.36 -29.66 69.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 53.310000000000002 111.13 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 34.9 m -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.812 0.339 . . . . 64.530000000000001 110.782 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -71.67 -32.6 68.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 73.450000000000003 109.917 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.98 84.05 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.784 -0.643 . . . . 71.5 110.17 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -70.31 -28.34 65.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.879 -0.6 . . . . 64.25 110.729 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.0 tp -66.92 -43.87 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 65.439999999999998 109.377 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.04 -42.22 99.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.192 -0.913 . . . . 73.019999999999996 109.678 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.487 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -62.58 -26.84 68.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.671 -0.695 . . . . 64.349999999999994 111.519 177.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.89 -12.82 60.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.326 -0.397 . . . . 63.049999999999997 111.951 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.528 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 81.7 mt -71.7 -51.77 8.82 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 111.893 0.331 . . . . 75.409999999999997 111.893 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 38.1 Cg_exo -59.83 -23.1 70.98 Favored 'Trans proline' 0 C--N 1.373 1.842 0 C-N-CA 121.836 1.691 . . . . 75.420000000000002 111.237 176.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.7 ' O ' HG22 ' A' ' 136' ' ' THR . 40.4 ttp -75.84 -47.79 24.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.89 -0.595 . . . . 71.140000000000001 110.441 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.0 tp -56.86 -36.42 70.02 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.655 0.613 . . . . 64.329999999999998 112.655 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 22.9 ptt180 -52.15 -29.27 21.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.91 0.708 . . . . 74.010000000000005 112.91 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.7 HG22 ' O ' ' A' ' 133' ' ' MET . 15.3 t -65.54 -39.18 91.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 120.594 -0.442 . . . . 65.420000000000002 111.223 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -71.97 -40.71 68.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 74.019999999999996 110.627 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.02 -28.91 65.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.046 -0.525 . . . . 70.400000000000006 111.423 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.93 -30.27 70.1 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.854 0.359 . . . . 64.519999999999996 110.995 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.05 -20.53 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 60.140000000000001 110.561 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 t -103.41 8.46 38.01 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.96 -0.564 . . . . 54.409999999999997 110.584 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.58 -17.79 52.86 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.613 -0.803 . . . . 54.119999999999997 113.383 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 53.2 mt -86.07 150.47 3.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.136 0.494 . . . . 73.310000000000002 111.155 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -140.59 136.72 33.06 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.874 -0.603 . . . . 72.430000000000007 109.673 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.474 HD22 HD23 ' A' ' 114' ' ' LEU . 48.9 mt -78.22 109.8 12.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.879 0.371 . . . . 60.219999999999999 111.117 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.34 -58.83 1.19 Allowed Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.613 -0.803 . . . . 33.409999999999997 111.24 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 113' ' ' GLN . 99.5 mt-30 -103.45 145.14 30.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.016 0.436 . . . . 71.140000000000001 110.719 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 27.7 m -141.18 130.49 23.64 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.307 -0.627 . . . . 33.240000000000002 109.307 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 38.0 m -149.87 141.6 23.64 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.747 0.308 . . . . 74.230000000000004 110.469 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 65.0 mt -137.01 142.5 37.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 108.433 -0.951 . . . . 72.340000000000003 108.433 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 21.5 t -140.27 168.3 20.13 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.933 -0.307 . . . . 72.239999999999995 110.495 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 118' ' ' SER . 20.4 m -84.62 -27.65 27.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.243 -0.435 . . . . 64.420000000000002 110.559 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HA ' HG13 ' A' ' 117' ' ' VAL . 15.1 pt-20 -171.06 -42.39 0.02 OUTLIER 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.182 0.515 . . . . 73.129999999999995 110.94 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.8 p -137.11 123.53 20.76 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.066 -0.516 . . . . 65.329999999999998 110.067 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -78.68 124.16 27.89 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 64.040000000000006 110.131 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -156.17 165.1 37.38 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.889 -0.596 . . . . 73.140000000000001 109.911 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 150.23 85.74 0.05 OUTLIER Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.624 -0.798 . . . . 71.540000000000006 112.229 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -77.19 128.23 34.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.72 0.295 . . . . 74.340000000000003 110.22 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.89 173.07 12.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.24 -0.437 . . . . 71.530000000000001 110.894 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -151.5 141.57 22.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.362 -0.381 . . . . 75.549999999999997 110.45 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 22.6 m -128.36 107.47 9.78 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.274 -0.421 . . . . 52.210000000000001 110.557 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 38.5 m -161.34 99.34 1.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.193 -0.458 . . . . 71.420000000000002 109.821 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 13.5 p -98.25 116.17 29.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.981 -0.554 . . . . 64.340000000000003 110.656 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -80.07 82.8 6.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.123 -0.489 . . . . 54.350000000000001 111.02 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -80.65 123.61 28.3 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.993 -0.549 . . . . 71.400000000000006 110.43 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -142.3 147.75 36.89 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.881 -0.599 . . . . 75.430000000000007 109.851 -178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.3 p -169.67 171.74 7.28 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.299 -0.26 . . . . 72.540000000000006 110.299 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 58.6 m -159.49 136.6 9.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.16 -0.311 . . . . 72.120000000000005 110.16 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 169' ' ' ARG . 52.4 mtt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.766 -0.635 . . . . 73.030000000000001 110.38 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 74.9 t60 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.686 -0.487 . . . . 65.209999999999994 109.686 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 71.01 130.19 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.398 0.679 . . . . 32.109999999999999 111.716 -177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.36 114.95 0.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.817 -0.629 . . . . 13.220000000000001 110.236 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.0 p -77.76 86.85 4.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.092 -0.503 . . . . 62.340000000000003 110.724 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.41 -62.67 1.58 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.293 -0.412 . . . . 75.0 111.048 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 t70 64.47 -86.34 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.732 0.645 . . . . 64.420000000000002 110.193 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.95 157.53 2.98 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.566 0.746 . . . . 74.129999999999995 109.363 176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.04 81.63 0.56 Allowed 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.282 0.563 . . . . 65.150000000000006 110.87 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.5 m -153.87 96.93 2.03 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.611 -0.722 . . . . 62.119999999999997 109.534 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -113.13 93.22 0.66 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.91 -0.662 . . . . 31.300000000000001 111.617 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.41 153.9 75.43 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.823 2.348 . . . . 53.200000000000003 112.208 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.0 118.61 1.77 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.88 -0.6 . . . . 35.399999999999999 110.289 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.41 175.89 13.41 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.086 -0.507 . . . . 75.230000000000004 110.735 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 p -85.01 147.94 49.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.251 -0.432 . . . . 61.049999999999997 111.553 -178.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.04 150.18 82.57 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.65 2.233 . . . . 74.340000000000003 111.35 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 tp -76.11 94.54 3.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.06 0.457 . . . . 72.140000000000001 111.248 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.61 160.49 2.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.859 -0.609 . . . . 73.450000000000003 110.049 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.9 p -155.72 153.32 7.7 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.15 -0.315 . . . . 71.209999999999994 110.15 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.71 147.9 8.79 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.647 -0.501 . . . . 73.239999999999995 109.647 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -168.81 162.11 11.33 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.033 -0.531 . . . . 45.5 109.96 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.95 148.75 8.73 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.262 -0.426 . . . . 74.409999999999997 110.183 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.99 118.39 2.06 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.794 -0.639 . . . . 74.109999999999999 109.562 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.2 t -154.72 -178.9 7.52 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.088 -0.506 . . . . 64.030000000000001 109.787 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.6 p -163.3 171.32 16.3 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 120.712 0.292 . . . . 72.209999999999994 110.515 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -163.69 -44.67 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.3 -0.63 . . . . 73.510000000000005 109.3 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.75 122.77 26.44 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.829 -0.623 . . . . 75.150000000000006 109.326 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -85.77 129.15 38.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.503 0.668 . . . . 52.439999999999998 111.364 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -160.47 -44.57 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.09 -0.959 . . . . 74.010000000000005 108.585 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.35 91.12 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 CA-C-N 115.173 -0.921 . . . . 64.310000000000002 109.243 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -76.41 -53.94 7.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.653 -0.703 . . . . 73.239999999999995 111.14 -176.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.0 m -83.25 133.79 47.01 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 115.989 -0.55 . . . . 72.120000000000005 110.499 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 33' ' ' PRO . 18.2 Cg_endo -60.75 120.82 8.76 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.626 2.218 . . . . 61.240000000000002 111.977 178.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 32' ' ' PRO . 24.5 Cg_exo -64.67 176.81 2.6 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 123.087 2.525 . . . . 64.420000000000002 112.181 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.47 154.1 84.97 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.961 -0.563 . . . . 60.009999999999998 110.256 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.99 -22.69 47.92 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 123.168 2.579 . . . . 74.409999999999997 113.309 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.77 -22.94 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.133 0.492 . . . . 62.130000000000003 110.524 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.3 m -91.48 143.0 27.05 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.607 -0.724 . . . . 72.049999999999997 109.324 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -88.12 134.63 33.72 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.281 -0.266 . . . . 72.140000000000001 110.281 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.96 -34.76 90.76 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.228 -0.51 . . . . 75.140000000000001 112.153 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.61 92.49 1.16 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.981 0.42 . . . . 55.32 110.857 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.82 95.19 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.888 -0.597 . . . . 53.109999999999999 110.068 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 60.8 mtt -144.9 92.14 5.86 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 109.313 -0.625 . . . . 71.409999999999997 109.313 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -85.36 103.64 0.8 Allowed 'Trans proline' 0 N--CA 1.448 -1.198 0 C-N-CA 122.683 2.255 . . . . 73.030000000000001 113.444 -177.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -85.06 99.53 11.09 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.03 -0.73 . . . . 64.099999999999994 109.03 175.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.15 121.32 3.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.934 -0.765 . . . . 60.399999999999999 108.934 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 m -158.24 13.92 0.2 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.788 0.328 . . . . 62.530000000000001 110.222 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.1 m 64.35 179.08 0.17 Allowed 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.738 -0.665 . . . . 72.109999999999999 111.719 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.08 -52.45 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.937 -0.574 . . . . 64.140000000000001 109.779 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.6 m 60.02 89.65 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.412 -0.813 . . . . 72.340000000000003 111.283 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.71 101.95 0.91 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-N 116.108 -0.497 . . . . 41.439999999999998 110.648 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.2 pm0 -81.17 144.8 54.96 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 115.51 -0.768 . . . . 74.409999999999997 110.36 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.84 116.48 4.31 Favored 'Trans proline' 0 C--O 1.239 0.529 0 C-N-CA 122.411 2.074 . . . . 75.329999999999998 111.782 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -77.64 127.74 81.6 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 63.119999999999997 111.191 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -80.06 116.21 3.36 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.71 2.273 . . . . 54.119999999999997 112.108 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.0 t -81.74 104.57 10.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.298 -0.41 . . . . 64.209999999999994 110.174 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.33 75.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 51.030000000000001 110.793 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.2 m -159.18 157.89 31.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.889 -0.596 . . . . 75.540000000000006 109.748 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 119.76 71.76 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 110.245 -0.28 . . . . 73.209999999999994 110.245 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -88.2 169.72 6.1 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.595 2.197 . . . . 74.409999999999997 112.519 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -89.63 151.69 3.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.251 -0.648 . . . . 74.450000000000003 109.251 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 33.6 tp -88.49 94.78 9.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.453 0.644 . . . . 74.109999999999999 110.965 -178.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.3 m -123.51 75.49 1.33 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.25 -0.886 . . . . 62.329999999999998 109.332 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.26 157.58 76.43 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-N 115.193 -0.912 . . . . 51.020000000000003 109.521 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.423 ' HB2' ' HB2' ' A' ' 67' ' ' SER . 70.5 Cg_exo -52.2 125.25 16.88 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.542 2.162 . . . . 61.439999999999998 111.732 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.26 114.11 5.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.034 -0.53 . . . . 74.530000000000001 110.987 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.38 -17.42 28.73 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.886 -0.673 . . . . 74.140000000000001 112.247 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' PRO . 45.4 t -61.39 150.12 36.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.747 0.308 . . . . 65.230000000000004 111.262 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -64.57 -41.24 96.42 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.957 -0.757 . . . . 54.450000000000003 108.957 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.48 -34.94 73.2 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.367 -0.833 . . . . 74.340000000000003 110.497 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -66.99 -46.23 75.21 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.757 -0.46 . . . . 75.209999999999994 109.757 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -64.84 -46.45 81.88 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.498 -0.319 . . . . 64.299999999999997 110.508 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -52.83 -40.83 63.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.107 -0.497 . . . . 61.140000000000001 111.097 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 57.7 m -65.67 -39.99 91.93 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.12 -0.491 . . . . 71.409999999999997 110.02 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -60.89 -54.42 45.22 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.055 -0.52 . . . . 74.200000000000003 110.323 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.6 m -50.84 -49.07 59.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.639 0.237 . . . . 63.210000000000001 111.639 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.76 -44.79 70.31 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.445 -0.343 . . . . 72.549999999999997 110.61 177.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.579 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -58.75 -39.36 80.72 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.953 -0.567 . . . . 73.319999999999993 111.345 177.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.64 -36.05 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 72.310000000000002 111.285 -177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 83' ' ' ARG . 77.6 mtp -68.65 -25.95 65.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.166 178.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.41 -38.7 77.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.605 -0.725 . . . . 70.420000000000002 110.171 176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 89' ' ' ALA . 28.1 m-85 -52.23 -53.75 39.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.901 -0.59 . . . . 64.439999999999998 111.992 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 79' ' ' MET . 14.7 t -68.6 -19.8 64.47 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 120.938 -0.305 . . . . 73.319999999999993 111.406 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 79' ' ' MET . 34.7 mmt180 -71.29 -57.01 4.87 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.137 0.494 . . . . 65.239999999999995 109.853 178.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -79.31 -26.12 42.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.547 -0.751 . . . . 63.340000000000003 112.062 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.44 11.46 58.26 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.57 -0.824 . . . . 44.399999999999999 112.645 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -81.94 119.36 23.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.885 0.374 . . . . 65.319999999999993 111.273 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.49 -4.16 47.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 112.176 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.5 t -151.29 145.31 25.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.587 0.232 . . . . 72.010000000000005 110.698 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 81' ' ' PHE . . . -161.41 164.38 29.92 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.058 -0.519 . . . . 74.430000000000007 110.07 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -114.59 119.63 37.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.859 0.362 . . . . 70.230000000000004 110.736 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 53.2 tp -103.77 125.5 50.27 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.535 -0.543 . . . . 74.409999999999997 109.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.529 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.4 mpt_? -79.36 142.46 36.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.694 -0.402 . . . . 64.519999999999996 110.065 178.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -142.31 141.2 32.37 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.987 -0.551 . . . . 74.319999999999993 110.719 -174.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.526 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 38.3 m80 -118.27 146.92 40.54 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.844 -0.616 . . . . 74.019999999999996 109.823 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 57.7 Cg_endo -68.77 146.77 80.83 Favored 'Cis proline' 0 C--N 1.353 0.798 0 C-N-CA 123.427 -1.489 . . . . 62.200000000000003 112.102 3.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -63.6 18.63 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.556 1.317 . . . . 74.349999999999994 114.556 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.7 -59.99 3.62 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.949 -1.13 . . . . 75.510000000000005 107.949 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.644 ' H ' HD12 ' A' ' 98' ' ' LEU . 2.0 mp -62.37 -31.91 72.64 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.888 -0.782 . . . . 70.239999999999995 108.888 171.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.99 -46.29 2.38 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-N 114.795 -1.093 . . . . 44.329999999999998 114.789 176.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.18 173.08 17.26 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.328 0.585 . . . . 71.219999999999999 111.67 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.3 t -128.92 123.32 58.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 108.03 -1.1 . . . . 62.310000000000002 108.03 175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 t-160 -100.23 103.56 15.01 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.466 -0.568 . . . . 73.5 109.466 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.569 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 21.4 mt -94.66 123.47 46.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-N 115.982 -0.554 . . . . 63.299999999999997 111.433 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -104.09 167.06 10.01 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.493 -0.928 . . . . 73.530000000000001 108.493 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.4 tp -152.47 113.97 4.3 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 121.064 -0.254 . . . . 61.020000000000003 110.864 -176.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.475 ' HB2' ' HB3' ' A' ' 113' ' ' GLN . 94.6 mttt -109.87 131.17 55.3 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.46 -0.941 . . . . 63.310000000000002 108.46 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.7 tt -134.08 118.27 17.55 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.598 -0.519 . . . . 63.210000000000001 109.598 -175.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -149.29 149.68 31.32 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 116.006 -0.543 . . . . 65.230000000000004 110.235 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.3 t70 59.69 -101.51 0.12 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.044 0.537 . . . . 75.150000000000006 111.224 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.42 29.61 1.59 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.514 0.673 . . . . 71.439999999999998 109.389 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.44 152.14 42.46 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.265 -0.879 . . . . 72.120000000000005 110.706 -178.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -126.77 138.36 53.36 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.018 -0.537 . . . . 60.32 110.849 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' LYS . 64.7 tt0 -104.13 112.76 25.9 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.703 -0.681 . . . . 73.219999999999999 109.235 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.651 ' HG ' ' SD ' ' A' ' 116' ' ' MET . 21.7 tp -98.93 133.0 43.83 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.948 -0.569 . . . . 71.299999999999997 110.298 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -139.01 140.03 38.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.759 -0.46 . . . . 75.129999999999995 109.759 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HG ' ' A' ' 114' ' ' LEU . 4.6 mpp? -137.22 135.58 37.37 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.479 -0.328 . . . . 64.25 110.263 -176.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 88.7 t -98.53 111.42 28.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.378 -0.601 . . . . 52.450000000000003 109.378 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.4 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 50.7 m -161.44 130.47 3.12 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.132 -0.94 . . . . 73.439999999999998 109.703 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 118' ' ' SER . 44.8 Cg_exo -58.34 175.22 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.114 2.542 . . . . 73.209999999999994 112.471 177.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -85.7 129.9 34.7 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.753 -0.462 . . . . 73.329999999999998 109.753 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.6 t -170.35 175.4 4.85 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.669 -0.863 . . . . 73.120000000000005 108.669 -177.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -66.75 -23.88 66.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.954 0.407 . . . . 74.319999999999993 110.012 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.9 t -65.88 -35.82 76.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 62.399999999999999 110.016 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -32.74 74.29 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.833 -0.621 . . . . 73.430000000000007 110.494 -178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.15 -50.06 69.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 44.32 110.553 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.64 -30.95 68.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 71.319999999999993 110.846 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.91 -48.68 80.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.198 -0.667 . . . . 73.150000000000006 109.198 178.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.46 -42.29 75.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.025 -0.534 . . . . 41.539999999999999 110.669 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.45 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -59.4 -18.44 38.94 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.184 0.439 . . . . 73.329999999999998 112.184 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.42 -16.2 57.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.611 0.243 . . . . 72.540000000000006 111.484 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 84.6 mt -69.53 -47.11 26.46 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 112.184 0.438 . . . . 71.239999999999995 112.184 -177.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.578 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 74.8 Cg_exo -52.0 -33.57 53.13 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 122.271 1.981 . . . . 71.030000000000001 112.466 176.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 137' ' ' GLN . 54.7 ttp -78.42 -36.19 45.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.519 0.676 . . . . 74.329999999999998 109.642 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 66.2 tp -69.88 -38.08 76.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.044 -0.98 . . . . 73.200000000000003 111.236 -176.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 132' ' ' PRO . 14.9 ptt180 -57.6 -36.99 72.47 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 120.819 0.342 . . . . 75.030000000000001 110.626 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 45.5 m -70.62 -38.02 73.87 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.31 -0.405 . . . . 63.539999999999999 110.676 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 133' ' ' MET . 21.5 mm-40 -67.66 -41.57 83.59 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.191 0.52 . . . . 52.039999999999999 109.701 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 143' ' ' ILE . 86.8 mt -72.56 -33.17 66.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.476 -0.784 . . . . 75.510000000000005 112.044 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.52 -35.87 72.94 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.997 0.427 . . . . 63.119999999999997 111.058 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -83.02 11.44 6.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.788 -0.642 . . . . 54.109999999999999 111.142 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.8 t -126.85 15.63 7.45 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.204 -0.665 . . . . 64.0 109.204 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 63.56 43.78 97.54 Favored Glycine 0 C--N 1.33 0.214 0 CA-C-N 115.351 -0.84 . . . . 73.239999999999995 112.117 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.447 ' HB ' ' HB3' ' A' ' 138' ' ' LEU . 61.7 mt -136.67 139.47 44.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.526 -0.546 . . . . 75.420000000000002 109.526 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -137.13 124.5 21.96 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.2 -0.296 . . . . 64.040000000000006 110.2 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 95.7 mt -74.72 109.75 8.44 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 120.888 0.375 . . . . 71.019999999999996 110.893 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -82.53 -77.6 1.07 Allowed Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.049 -0.821 . . . . 64.049999999999997 111.049 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.636 HE21 ' HA ' ' A' ' 147' ' ' GLN . 0.1 OUTLIER -103.75 151.67 22.76 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.648 -0.501 . . . . 64.109999999999999 109.648 177.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 114' ' ' LEU . 23.8 m -151.15 121.13 7.13 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.059 -0.719 . . . . 63.030000000000001 109.059 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.8 m -140.32 105.01 4.91 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 113.753 1.02 . . . . 61.219999999999999 113.753 -177.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 116' ' ' MET . 43.8 mt -77.09 115.04 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.119 -0.491 . . . . 72.5 110.027 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 10.3 m -108.13 149.36 28.6 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.039 -0.726 . . . . 72.010000000000005 109.039 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 50.9 m -80.45 -33.93 36.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.449 -0.575 . . . . 62.219999999999999 109.449 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -159.05 -37.48 0.06 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.205 -0.907 . . . . 61.020000000000003 110.163 178.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.6 m -135.63 -73.64 0.45 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.28 -0.418 . . . . 63.229999999999997 111.308 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.71 160.87 38.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.625 0.25 . . . . 63.32 110.658 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.67 102.76 11.71 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.355 -0.384 . . . . 62.329999999999998 110.495 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -84.16 160.44 36.69 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.738 -0.744 . . . . 45.25 111.621 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -152.05 -177.82 6.39 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.892 0.377 . . . . 62.030000000000001 110.513 -179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -161.57 155.6 22.18 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.686 -0.688 . . . . 75.450000000000003 109.866 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -147.48 93.5 2.23 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.559 -0.534 . . . . 74.430000000000007 109.559 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 18.2 m -71.69 152.36 42.88 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.688 -0.687 . . . . 55.240000000000002 109.999 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 17.3 p -169.65 108.96 0.41 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.42 -0.354 . . . . 74.549999999999997 110.44 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 48.3 t -151.03 134.78 16.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.875 0.369 . . . . 74.319999999999993 110.651 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -160.37 155.87 25.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.008 -0.542 . . . . 52.5 110.459 178.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -162.79 175.16 11.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.264 -0.425 . . . . 54.210000000000001 110.181 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . 0.46 ' HA ' ' OE1' ' A' ' 166' ' ' GLN . 6.6 tp60 -131.76 121.56 24.39 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.019 177.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.8 t -168.59 175.62 6.09 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.083 -0.71 . . . . 63.520000000000003 109.083 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 53.2 m -158.38 153.5 25.46 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.687 0.279 . . . . 71.530000000000001 110.254 -179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.438 -0.791 . . . . 64.349999999999994 109.747 177.92 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.4 m80 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.959 0.409 . . . . 74.439999999999998 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -117.17 -173.2 2.36 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.943 -0.571 . . . . 74.409999999999997 110.47 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.84 96.0 0.44 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.855 -0.611 . . . . 71.150000000000006 109.707 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -74.92 104.58 5.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.837 -0.62 . . . . 60.43 111.397 -178.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.53 -51.06 6.4 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.258 -0.645 . . . . 73.0 109.258 176.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 t70 60.69 -166.24 0.2 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.996 -1.002 . . . . 71.329999999999998 111.133 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -153.01 162.09 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.641 0.258 . . . . 70.219999999999999 110.577 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -167.26 152.01 7.1 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.932 -0.576 . . . . 64.030000000000001 109.879 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.2 m -150.88 94.95 2.14 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.976 0.417 . . . . 74.019999999999996 110.094 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -128.65 86.96 0.32 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.645 -0.788 . . . . 71.209999999999994 112.35 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.45 136.24 33.29 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.644 2.229 . . . . 54.229999999999997 111.549 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 131.8 45.04 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.933 -0.576 . . . . 71.340000000000003 109.963 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.5 mt -141.95 133.24 26.41 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.163 -0.472 . . . . 73.319999999999993 109.941 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.9 p -82.66 122.15 78.32 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 116.071 -0.513 . . . . 53.310000000000002 110.39 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -57.3 128.69 30.59 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.489 2.126 . . . . 72.439999999999998 111.339 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.09 105.18 5.98 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 121.1 0.476 . . . . 62.530000000000001 110.087 -178.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.34 139.11 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.623 -0.717 . . . . 72.400000000000006 109.696 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.8 p -85.19 146.72 6.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.052 -0.351 . . . . 61.420000000000002 110.052 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.25 173.7 12.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.284 -0.417 . . . . 64.239999999999995 110.123 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -166.26 -165.06 0.74 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 109.883 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.86 161.44 25.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.984 -0.376 . . . . 51.119999999999997 109.984 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.04 159.45 20.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.947 0.403 . . . . 61.140000000000001 110.746 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.8 p -147.89 145.81 28.8 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.004 -0.739 . . . . 51.329999999999998 109.004 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.5 p -165.82 136.18 3.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.852 0.358 . . . . 53.32 111.337 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.98 88.89 0.33 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.8 -0.636 . . . . 54.520000000000003 109.818 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -160.95 138.76 9.44 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.515 -0.766 . . . . 74.510000000000005 109.423 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.4 m -99.87 121.9 51.11 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-O 121.437 0.637 . . . . 64.019999999999996 112.043 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -86.09 109.4 18.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.808 -0.633 . . . . 70.049999999999997 110.078 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.5 p -83.17 114.19 23.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-O 121.239 0.542 . . . . 71.0 110.27 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -158.74 107.99 1.96 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.908 -0.587 . . . . 53.119999999999997 110.305 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.4 p -154.28 85.86 3.76 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-N 115.941 -0.572 . . . . 72.329999999999998 110.607 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -78.99 125.0 6.33 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.477 2.118 . . . . 72.030000000000001 112.092 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -54.63 132.4 51.21 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.878 2.385 . . . . 65.329999999999998 112.021 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.33 136.38 81.48 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.011 -0.54 . . . . 75.450000000000003 111.087 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -83.56 -155.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.702 2.268 . . . . 71.519999999999996 111.317 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -79.8 -41.61 21.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 120.94 -0.304 . . . . 44.229999999999997 110.941 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 21.8 m 50.82 81.89 0.06 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.457 0.703 . . . . 64.150000000000006 111.955 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -120.98 136.18 55.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.89 0.376 . . . . 75.129999999999995 111.002 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -162.99 110.36 0.42 Allowed Glycine 0 N--CA 1.437 -1.294 0 N-CA-C 111.435 -0.666 . . . . 44.109999999999999 111.435 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 42' ' ' MET . . . -165.77 -44.31 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 110.532 -0.173 . . . . 71.230000000000004 110.532 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 72.65 -35.46 0.33 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 61.020000000000003 111.993 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.406 ' H ' ' C ' ' A' ' 40' ' ' ALA . 24.8 ptt? -155.77 155.91 30.02 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.041 -0.726 . . . . 73.310000000000002 109.041 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.75 177.28 3.57 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 122.248 1.965 . . . . 71.439999999999998 111.618 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.9 p -81.09 145.07 31.27 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.668 -0.242 . . . . 75.510000000000005 110.824 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -159.9 178.13 10.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.567 -0.531 . . . . 71.25 109.567 -178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -76.68 -98.56 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.416 0.151 . . . . 64.030000000000001 110.891 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.4 m 59.83 172.92 0.08 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.682 0.623 . . . . 74.140000000000001 112.682 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 65.62 2.44 2.07 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.258 -0.883 . . . . 52.039999999999999 113.109 176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -91.04 -52.77 4.68 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.608 0.242 . . . . 74.430000000000007 111.199 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.69 -169.54 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.612 -0.722 . . . . 72.019999999999996 111.454 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -82.85 129.17 62.92 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 116.357 -0.383 . . . . 73.329999999999998 110.19 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.69 166.55 29.49 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.732 2.288 . . . . 71.439999999999998 111.985 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.3 mp -89.15 114.87 61.95 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 72.329999999999998 110.043 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -79.79 174.46 11.64 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.731 2.287 . . . . 65.120000000000005 112.625 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t 73.68 143.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 115.571 -0.741 . . . . 64.340000000000003 111.281 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.84 163.9 18.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.947 -0.57 . . . . 64.530000000000001 110.666 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t 65.85 81.11 0.21 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.439 0.638 . . . . 61.049999999999997 109.506 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.4 147.7 95.15 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 115.365 -0.834 . . . . 64.010000000000005 110.687 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -63.89 177.72 1.74 Allowed 'Trans proline' 0 C--O 1.236 0.414 0 C-N-CA 122.554 2.169 . . . . 55.130000000000003 111.625 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.98 176.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 116.329 -0.396 . . . . 54.240000000000002 110.844 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.68 89.1 7.87 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.207 0.527 . . . . 75.409999999999997 110.296 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.2 p -125.93 78.05 1.72 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.786 -0.643 . . . . 71.450000000000003 110.716 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.37 157.88 74.55 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.973 -1.012 . . . . 75.140000000000001 108.906 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.15 127.24 10.58 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.706 2.271 . . . . 63.020000000000003 111.521 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.6 tp -68.41 105.98 2.37 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 62.240000000000002 110.943 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.23 -18.25 12.27 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.744 -0.662 . . . . 65.120000000000005 111.765 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' TRP . 46.4 t -61.4 154.83 23.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.102 0.477 . . . . 62.299999999999997 111.192 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.55 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 92.7 m-70 -74.7 -25.07 58.9 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.414 . . . . 73.420000000000002 109.93 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.48 -26.77 62.84 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.521 -0.918 . . . . 75.129999999999995 108.521 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' SER . 89.5 t90 -72.15 -42.84 65.49 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.242 -1.345 . . . . 74.109999999999999 108.278 176.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -65.84 -30.57 71.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 73.409999999999997 111.28 176.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 68' ' ' HIS . 14.8 mm-40 -74.43 -39.74 62.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.012 0.434 . . . . 75.319999999999993 110.952 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.9 m -70.37 -28.34 65.03 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.267 0.556 . . . . 75.439999999999998 109.924 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.63 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 83.2 t80 -78.89 -50.36 11.34 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.698 -0.683 . . . . 73.230000000000004 110.731 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.4 p -54.39 -33.59 59.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.615 0.598 . . . . 70.329999999999998 112.615 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -75.34 -39.88 58.87 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 120.672 -0.411 . . . . 74.310000000000002 111.527 -178.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.1 pt20 -63.8 -21.42 66.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.888 0.375 . . . . 74.310000000000002 111.028 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 74' ' ' PHE . 61.0 t -81.51 -19.58 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.356 0.598 . . . . 74.329999999999998 110.062 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 31.2 mmt -69.76 -26.04 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 109.713 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.65 -32.9 69.51 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.845 -0.616 . . . . 63.329999999999998 110.87 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -55.14 -57.69 10.73 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.976 -0.556 . . . . 74.329999999999998 111.033 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.9 t -73.91 -25.49 60.02 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.182 -0.463 . . . . 61.509999999999998 112.026 -177.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 79' ' ' MET . 99.0 mtt180 -73.45 -62.41 1.49 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.319999999999993 111.278 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -79.18 -10.03 59.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 74.349999999999994 111.158 -177.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.37 9.83 86.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.772 -0.728 . . . . 60.420000000000002 111.479 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.13 108.26 16.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.162 0.506 . . . . 62.130000000000003 111.475 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.03 32.06 0.27 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.092 0.472 . . . . 61.409999999999997 110.667 177.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.8 p -154.23 157.13 38.3 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.848 -0.615 . . . . 72.329999999999998 109.705 -177.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 138.65 7.71 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.98 0.419 . . . . 73.209999999999994 112.054 -178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -99.28 116.12 30.72 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 109.301 -0.629 . . . . 61.340000000000003 109.301 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.453 HD13 HE22 ' A' ' 77' ' ' GLN . 35.3 tp -108.9 115.01 29.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.015 0.436 . . . . 62.219999999999999 111.177 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -82.38 135.38 35.18 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.544 -0.753 . . . . 75.129999999999995 109.25 177.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 101' ' ' VAL . 95.6 mt -149.3 172.6 14.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.951 0.405 . . . . 63.229999999999997 110.961 -174.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.672 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 11.3 p-80 -117.94 147.67 41.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.043 -0.725 . . . . 63.329999999999998 109.043 174.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.672 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 63.9 Cg_exo -51.39 135.79 4.13 Favored 'Cis proline' 0 C--N 1.364 1.343 0 CA-C-N 119.611 0.897 . . . . 61.130000000000003 114.056 2.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -74.55 -17.58 60.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.342 -0.845 . . . . 72.129999999999995 111.662 -176.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -55.49 -44.14 76.25 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.597 -0.52 . . . . 44.130000000000003 109.597 175.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.73 -67.25 0.65 Allowed 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.273 -1.751 . . . . 70.099999999999994 106.273 171.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.592 ' O ' ' HA ' ' A' ' 92' ' ' ARG . . . 74.53 -41.55 1.18 Allowed Glycine 0 C--O 1.22 -0.743 0 CA-C-N 114.216 -1.356 . . . . 70.549999999999997 115.596 171.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -107.14 132.5 52.95 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 117.762 0.781 . . . . 73.299999999999997 112.847 -174.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 93' ' ' LEU . 44.7 t -131.75 118.02 36.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.977 -1.01 . . . . 63.210000000000001 108.883 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -94.23 114.76 26.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.07 0.462 . . . . 74.230000000000004 111.385 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.409 HG22 ' N ' ' A' ' 104' ' ' SER . 23.5 mt -86.45 161.88 2.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.696 -0.684 . . . . 73.140000000000001 110.511 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 115' ' ' GLN . 48.1 t -143.61 145.6 32.62 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.961 -1.018 . . . . 64.239999999999995 110.452 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 36.9 tp -140.72 154.75 46.46 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.888 0.375 . . . . 74.219999999999999 110.11 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 112' ' ' ALA . 64.3 tttp -140.26 136.04 32.91 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.127 -0.694 . . . . 70.109999999999999 109.127 178.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.4 tp -119.94 101.59 7.97 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.198 0.523 . . . . 73.519999999999996 109.762 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -109.04 111.22 22.74 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.709 -0.678 . . . . 72.239999999999995 109.435 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 51.96 -80.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 113.678 0.992 . . . . 72.519999999999996 113.678 -176.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -144.59 30.84 1.2 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.356 0.598 . . . . 72.299999999999997 110.337 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -139.77 131.58 27.53 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.459 -0.791 . . . . 53.130000000000003 109.422 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -108.95 116.86 32.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 65.120000000000005 110.767 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -89.82 127.93 36.07 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.051 0.453 . . . . 60.32 109.967 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.75 109.26 21.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.573 -0.739 . . . . 74.25 110.057 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 104' ' ' SER . 26.7 mt-30 -105.57 150.67 25.17 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.6 -0.727 . . . . 54.210000000000001 109.45 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 64.5 mtm -142.55 139.62 31.47 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.937 0.399 . . . . 73.530000000000001 111.735 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 48.1 t -114.88 103.86 15.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 107.644 -1.243 . . . . 61.229999999999997 107.644 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 152' ' ' SER . 19.2 m -157.54 154.33 25.04 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 116.196 -0.456 . . . . 53.130000000000003 110.334 -174.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.24 173.34 4.22 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.598 2.198 . . . . 70.439999999999998 111.613 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -111.24 112.53 24.38 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 120.99 0.424 . . . . 73.299999999999997 110.467 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 16.6 t -168.26 -164.59 0.54 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.084 -0.71 . . . . 64.200000000000003 109.084 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -60.97 -20.5 62.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.374 0.27 . . . . 75.200000000000003 111.381 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.6 m -66.72 -20.2 26.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 CA-C-O 121.132 0.491 . . . . 72.319999999999993 110.743 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.524 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 58.2 ttp180 -75.87 -37.3 59.06 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.083 -0.71 . . . . 74.129999999999995 109.083 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.36 -34.19 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.017 -0.992 . . . . 72.400000000000006 111.195 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -72.91 -39.04 66.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.181 -0.463 . . . . 74.010000000000005 111.145 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.65 -37.4 82.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.787 0.327 . . . . 73.099999999999994 110.508 178.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 47.3 mt-10 -63.01 -42.45 99.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.191 0.52 . . . . 64.25 109.871 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.53 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -66.7 -32.36 73.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.645 -0.707 . . . . 63.219999999999999 111.369 178.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -75.62 -15.18 60.37 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.024 0.749 . . . . 75.420000000000002 113.024 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.48 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 94.0 mt -52.45 -51.99 67.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 113.291 0.848 . . . . 73.340000000000003 113.291 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 52.1 Cg_exo -56.21 -31.16 82.86 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.045 1.83 . . . . 64.340000000000003 111.94 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -75.62 -49.17 19.28 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.675 -0.693 . . . . 63.439999999999998 109.521 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 36.5 tp -64.27 -37.26 86.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.195 -0.911 . . . . 74.319999999999993 111.958 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 132' ' ' PRO . 4.7 ppt_? -66.2 -21.27 66.3 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.037 0.446 . . . . 62.130000000000003 110.049 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 59.9 m -81.29 -40.85 23.02 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.614 -0.721 . . . . 63.130000000000003 109.893 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -61.54 -42.19 98.46 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.311 -0.404 . . . . 64.140000000000001 111.477 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.58 -29.42 62.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.015 0.436 . . . . 72.439999999999998 110.353 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.91 -29.31 69.71 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.83 -0.623 . . . . 65.310000000000002 111.41 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -82.97 -1.49 52.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.239 0.543 . . . . 75.519999999999996 110.84 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 t -98.28 3.31 48.75 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.065 -0.717 . . . . 72.530000000000001 109.065 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 77.62 0.77 74.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.46 -0.791 . . . . 53.240000000000002 113.018 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.69 140.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.801 0.334 . . . . 75.129999999999995 110.169 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -87.25 158.91 18.99 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.353 -0.385 . . . . 45.229999999999997 110.118 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -96.84 125.08 41.03 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.669 -0.863 . . . . 54.240000000000002 108.669 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -87.72 -122.47 1.73 Allowed Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.462 -0.875 . . . . 74.5 112.496 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -78.38 174.99 10.68 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.269 0.557 . . . . 74.340000000000003 110.78 -178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 50.6 m -140.43 136.28 32.88 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.927 -0.768 . . . . 60.219999999999999 108.927 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 28.4 m -143.12 142.13 31.41 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.134 0.492 . . . . 64.409999999999997 111.532 -177.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 60.3 mt -135.1 123.28 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.05 -1.093 . . . . 74.530000000000001 108.05 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 19.5 m -143.69 141.3 30.46 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.72 -0.392 . . . . 74.420000000000002 111.482 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 118' ' ' SER . 54.2 m -86.14 -28.1 24.2 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 72.409999999999997 110.04 177.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -135.73 -61.51 0.72 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.77 -0.65 . . . . 74.239999999999995 110.41 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.1 t -145.26 -170.95 3.56 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.64 -0.504 . . . . 64.5 109.64 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -77.41 126.9 31.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.788 0.328 . . . . 74.439999999999998 110.503 -178.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -155.77 171.43 20.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.885 -0.598 . . . . 74.530000000000001 110.227 -178.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 137.81 -159.32 24.96 Favored Glycine 0 N--CA 1.437 -1.265 0 C-N-CA 120.529 -0.843 . . . . 63.119999999999997 112.341 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -150.64 157.47 43.01 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.776 -0.824 . . . . 74.329999999999998 108.776 -178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -78.89 112.94 16.57 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.794 -0.446 . . . . 64.230000000000004 109.794 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -85.51 69.98 10.72 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.487 0.66 . . . . 74.230000000000004 111.045 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.1 m -90.77 148.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.451 -0.795 . . . . 73.409999999999997 109.715 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 45.1 p -167.22 145.28 4.83 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.76 0.314 . . . . 45.140000000000001 110.741 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.0 m -145.7 152.27 39.34 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.214 -0.662 . . . . 54.210000000000001 109.214 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -158.82 109.52 2.06 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.781 0.324 . . . . 74.219999999999999 110.287 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.14 104.65 9.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.294 0.569 . . . . 63.119999999999997 111.165 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 166' ' ' GLN . 0.1 OUTLIER -97.77 86.93 3.9 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.546 0.688 . . . . 74.299999999999997 109.959 178.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 11.2 t -73.78 95.22 2.36 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.685 -0.689 . . . . 61.25 111.058 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 13.3 m -79.07 162.27 25.98 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.723 -0.843 . . . . 74.340000000000003 108.723 176.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 118.168 -0.92 . . . . 72.150000000000006 109.587 178.443 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 34.5 m80 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.954 0.407 . . . . 72.430000000000007 111.003 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.0 mmt -135.67 162.39 32.87 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.981 -0.748 . . . . 73.109999999999999 108.981 177.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.02 149.74 5.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.853 0.358 . . . . 51.350000000000001 110.697 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.5 m -74.24 105.7 5.55 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.793 -0.639 . . . . 74.340000000000003 110.285 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -81.72 -56.57 3.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.073 -0.512 . . . . 74.439999999999998 110.117 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 60.61 -175.85 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.969 -0.56 . . . . 74.230000000000004 112.435 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -160.83 85.84 0.7 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.541 -0.54 . . . . 73.120000000000005 109.541 178.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.75 140.67 42.53 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.952 -0.567 . . . . 63.020000000000003 110.535 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -153.45 134.56 14.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.27 -0.423 . . . . 74.329999999999998 110.164 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.55 73.67 0.25 Allowed Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.853 -0.689 . . . . 43.140000000000001 111.978 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.8 -172.91 1.46 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.917 2.412 . . . . 72.140000000000001 111.846 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -163.3 162.28 25.08 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.152 -0.476 . . . . 73.209999999999994 110.49 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 96.6 mt -144.69 141.72 29.52 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.945 -0.761 . . . . 75.319999999999993 108.945 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -85.81 120.48 72.8 Favored Pre-proline 0 C--N 1.309 -1.174 0 CA-C-N 116.412 -0.358 . . . . 75.109999999999999 111.405 -178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -62.1 134.43 49.24 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.215 1.944 . . . . 63.310000000000002 109.822 175.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.4 mt -148.38 116.88 6.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.057 0.456 . . . . 71.099999999999994 110.989 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 p -154.93 146.49 13.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.424 -0.807 . . . . 72.430000000000007 109.223 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -151.83 155.39 6.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 109.979 -0.378 . . . . 42.039999999999999 109.979 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.14 153.11 11.46 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.863 -0.421 . . . . 62.539999999999999 109.863 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -167.73 140.77 3.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.285 0.365 . . . . 70.549999999999997 110.369 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.49 136.24 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.124 -0.489 . . . . 55.450000000000003 110.151 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.88 173.7 6.91 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.257 0.348 . . . . 63.240000000000002 110.638 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 p -145.65 150.28 36.03 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.593 -0.276 . . . . 64.319999999999993 110.778 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.6 m -162.5 142.72 9.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 109.843 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -168.55 166.63 11.97 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 123.245 0.341 . . . . 64.439999999999998 110.421 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -159.49 166.13 31.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.428 -0.351 . . . . 75.209999999999994 110.628 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 m -141.98 -175.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.321 -0.4 . . . . 63.439999999999998 110.401 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -145.99 145.92 30.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.827 0.346 . . . . 73.510000000000005 110.761 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.7 m -88.19 -169.98 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.952 -0.567 . . . . 63.329999999999998 110.149 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 23.8 t70 -152.71 137.65 17.18 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.734 0.302 . . . . 63.340000000000003 110.804 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.2 m -85.79 110.6 31.41 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 116.01 -0.541 . . . . 64.329999999999998 110.395 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 30' ' ' ASP . 22.8 Cg_exo -65.39 127.37 18.04 Favored 'Trans proline' 0 C--O 1.238 0.49 0 C-N-CA 122.597 2.198 . . . . 62.229999999999997 111.788 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -65.03 134.13 38.5 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.657 2.238 . . . . 62.439999999999998 112.195 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.37 139.87 92.34 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.529 -0.545 . . . . 55.140000000000001 109.529 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.22 49.43 1.05 Allowed 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.884 2.39 . . . . 74.329999999999998 113.442 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.9 t -87.05 99.05 7.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.953 0.406 . . . . 75.310000000000002 110.041 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.0 p -91.51 -13.69 31.71 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.07 -0.514 . . . . 73.140000000000001 111.278 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -80.85 145.68 31.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.193 -0.458 . . . . 73.109999999999999 110.391 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 110.73 138.82 7.91 Favored Glycine 0 N--CA 1.438 -1.212 0 C-N-CA 120.741 -0.743 . . . . 64.420000000000002 111.717 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -164.15 100.35 0.85 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.034 0.445 . . . . 71.349999999999994 110.391 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -167.14 88.08 0.3 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.512 -0.767 . . . . 64.420000000000002 109.575 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -86.6 120.38 71.91 Favored Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 115.598 -0.728 . . . . 44.030000000000001 110.66 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.96 142.27 61.54 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.295 1.996 . . . . 74.349999999999994 110.95 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -151.25 157.24 42.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 116.691 -0.231 . . . . 72.329999999999998 110.662 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 tp 60.37 63.45 1.38 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.959 0.787 . . . . 74.409999999999997 111.505 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 p -170.39 135.66 1.26 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.781 -0.645 . . . . 74.239999999999995 110.196 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.5 m -135.52 -51.97 0.75 Allowed 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.375 -0.232 . . . . 74.510000000000005 110.375 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 61.51 -177.45 0.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.809 -0.632 . . . . 62.109999999999999 112.597 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.1 m -148.09 125.3 11.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.532 -0.758 . . . . 71.340000000000003 109.113 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -164.91 152.95 11.77 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.308 -0.256 . . . . 50.25 110.308 -178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -82.23 151.39 66.15 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.284 -0.416 . . . . 74.400000000000006 110.13 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.507 ' HA ' ' OE1' ' A' ' 137' ' ' GLN . 60.9 Cg_exo -53.45 123.37 13.14 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.902 2.401 . . . . 72.120000000000005 111.963 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 90.2 mt -69.36 124.17 89.91 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 116.09 -0.505 . . . . 41.509999999999998 111.072 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 16.0 Cg_exo -67.84 111.73 2.48 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.286 1.991 . . . . 74.319999999999993 110.573 177.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 m -77.61 152.63 5.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.119 0.485 . . . . 75.340000000000003 111.753 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.4 -174.66 2.3 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.331 -0.85 . . . . 74.120000000000005 109.279 -178.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -71.96 122.17 20.38 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.403 -0.592 . . . . 61.25 109.403 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.92 114.82 22.62 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 55.420000000000002 112.393 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.81 -179.98 3.13 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.426 2.751 . . . . 34.210000000000001 110.919 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.2 m -79.9 130.77 35.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.318 -0.623 . . . . 72.530000000000001 109.318 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 36.9 tp -91.4 130.19 37.28 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.307 0.575 . . . . 71.450000000000003 112.186 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 p -134.35 75.32 1.58 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.531 -0.759 . . . . 75.120000000000005 109.946 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.04 154.01 77.26 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.873 -0.603 . . . . 52.200000000000003 110.465 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.36 133.36 55.71 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.746 2.297 . . . . 55.340000000000003 111.922 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.4 mt -71.1 111.47 6.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.025 -0.534 . . . . 71.329999999999998 110.797 -177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 121.98 -28.13 5.96 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 115.658 -0.701 . . . . 64.219999999999999 111.497 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.8 t -59.22 149.05 29.53 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.644 0.378 . . . . 75.129999999999995 110.97 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -68.67 -30.17 68.79 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 116.545 -0.298 . . . . 64.439999999999998 110.351 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.28 -40.37 90.16 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.37 0.605 . . . . 71.319999999999993 109.606 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.417 ' HE1' HD22 ' A' ' 93' ' ' LEU . 87.5 t90 -66.11 -45.78 79.92 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.126 -0.943 . . . . 74.540000000000006 109.81 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -62.21 -50.02 73.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.427 -0.351 . . . . 55.25 111.565 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -51.08 -52.92 38.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.039 0.536 . . . . 74.120000000000005 111.483 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 14.3 m -66.84 -41.18 87.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.96 -0.564 . . . . 73.230000000000004 111.136 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 77.3 t80 -64.36 -60.31 3.32 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.427 0.529 . . . . 72.129999999999995 112.427 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -74.3 8.78 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 115.267 1.581 . . . . 73.329999999999998 115.267 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 73' ' ' THR . 30.0 pt20 -89.08 -15.68 33.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.425 1.011 . . . . 62.100000000000001 109.509 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 23.9 pt20 -71.58 -18.15 62.25 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.063 -0.971 . . . . 64.310000000000002 111.24 -177.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.606 ' HA ' ' CD2' ' A' ' 81' ' ' PHE . 25.7 t -76.46 -30.32 19.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.102 0.477 . . . . 73.340000000000003 110.127 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 86.3 mtp -76.02 -12.41 60.13 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.99 -0.745 . . . . 75.439999999999998 108.99 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.71 -41.55 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.866 -1.061 . . . . 74.439999999999998 109.853 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CD2' ' HA ' ' A' ' 78' ' ' VAL . 21.6 m-30 -49.09 -52.48 25.58 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.883 -0.599 . . . . 73.349999999999994 111.814 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 9.8 t -63.88 -22.71 67.04 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.382 -0.372 . . . . 60.100000000000001 111.962 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.1 mtp180 -75.22 -55.7 5.46 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 74.329999999999998 111.143 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -77.77 -19.4 55.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.247 0.462 . . . . 70.040000000000006 112.247 -177.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 83.18 21.71 58.39 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.3 -0.952 . . . . 63.130000000000003 112.502 178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -82.25 -172.28 3.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.391 -0.596 . . . . 73.510000000000005 109.391 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -160.3 8.38 0.09 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.305 -0.558 . . . . 72.25 111.775 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 103' ' ' ILE . 19.9 t -148.16 145.11 28.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 109.863 -0.421 . . . . 73.439999999999998 109.863 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -152.88 151.75 30.74 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.923 -0.581 . . . . 72.140000000000001 110.844 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 101' ' ' VAL . 47.6 mt-30 -125.39 115.21 19.94 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.961 -0.755 . . . . 63.219999999999999 108.961 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.8 tp -112.05 139.48 47.53 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.492 -0.322 . . . . 74.540000000000006 110.394 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -86.17 149.68 24.94 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.971 0.415 . . . . 75.120000000000005 110.825 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.417 HD22 ' HE1' ' A' ' 70' ' ' TRP . 32.7 mt -139.92 143.79 36.8 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 75.319999999999993 110.246 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.505 ' HA ' ' C ' ' A' ' 95' ' ' PRO . 80.4 m80 -113.38 136.59 21.89 Favored Pre-proline 0 C--N 1.314 -0.976 0 CA-C-N 116.034 -0.53 . . . . 61.119999999999997 109.78 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 94' ' ' HIS . 53.3 Cg_endo -67.72 146.33 76.73 Favored 'Cis proline' 0 C--N 1.348 0.51 0 C-N-CA 123.675 -1.385 . . . . 43.130000000000003 111.963 1.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -74.57 31.24 0.09 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.576 0.584 . . . . 52.130000000000003 112.576 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.89 -58.52 8.04 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.542 -0.91 . . . . 74.120000000000005 108.542 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.5 -28.61 69.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.592 -0.731 . . . . 63.030000000000001 109.608 174.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.07 -45.54 3.34 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.01 -0.995 . . . . 72.540000000000006 113.955 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -159.0 -179.67 8.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.187 0.518 . . . . 73.129999999999995 111.192 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 90.6 t -134.05 124.05 45.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 107.642 -1.244 . . . . 72.049999999999997 107.642 174.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 7.9 t60 -101.71 103.2 13.95 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.251 -0.648 . . . . 60.329999999999998 109.251 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 88' ' ' SER . 51.8 mt -94.79 123.75 47.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 116.053 -0.521 . . . . 61.229999999999997 111.956 -177.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.516 ' HB2' ' HB2' ' A' ' 115' ' ' GLN . 50.4 m -101.63 162.62 12.77 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.158 -1.053 . . . . 51.32 108.158 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -152.66 148.86 27.79 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.487 -0.485 . . . . 60.149999999999999 111.65 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.566 ' HB3' ' HB3' ' A' ' 113' ' ' GLN . 40.0 ttpt -132.97 130.4 39.48 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.977 -1.12 . . . . 65.299999999999997 107.977 172.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 62.4 tp -129.03 97.56 4.66 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.026 0.441 . . . . 74.239999999999995 110.564 -177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' A' ' 110' ' ' ASN . 18.0 t70 -101.24 114.98 29.46 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.057 -0.72 . . . . 75.430000000000007 109.057 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.7 t70 46.46 -73.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 114.215 1.191 . . . . 72.530000000000001 114.215 -176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' ASP . 8.3 p30 -139.58 19.82 2.53 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 120.637 0.256 . . . . 75.140000000000001 111.243 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 144' ' ' GLN . 27.9 pt20 -125.64 129.5 49.72 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.721 -0.392 . . . . 53.530000000000001 110.201 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 106' ' ' LYS . . . -117.58 128.32 54.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.166 -0.47 . . . . 71.219999999999999 111.909 -177.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.566 ' HB3' ' HB3' ' A' ' 106' ' ' LYS . 38.7 tt0 -100.46 120.64 40.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.775 -0.648 . . . . 74.299999999999997 109.358 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.8 136.49 35.05 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.203 0.525 . . . . 71.420000000000002 110.789 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.1 mt-30 -136.52 136.77 39.64 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.773 -0.825 . . . . 65.420000000000002 108.773 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -135.71 126.81 27.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.992 0.425 . . . . 72.219999999999999 111.397 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 102' ' ' HIS . 55.6 t -104.11 114.82 44.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 CA-C-N 115.755 -0.657 . . . . 71.430000000000007 109.313 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 152' ' ' SER . 47.6 p -163.53 137.68 4.61 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.021 -0.99 . . . . 74.099999999999994 109.029 -177.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -50.82 169.25 0.18 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.036 2.49 . . . . 33.32 112.948 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -88.29 113.86 24.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.381 0.61 . . . . 61.310000000000002 111.732 -174.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 15.0 t -164.29 -168.75 1.62 Allowed 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.093 -0.958 . . . . 73.310000000000002 108.99 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -69.82 -8.48 48.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.324 0.49 . . . . 74.040000000000006 112.324 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 28.7 m -62.42 -29.17 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 116.788 -0.187 . . . . 71.239999999999995 110.794 176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -72.17 -36.13 69.19 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.948 -0.301 . . . . 51.32 110.371 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -53.07 62.29 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.223 0.535 . . . . 64.120000000000005 110.006 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.07 -27.64 65.81 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.328 -0.851 . . . . 53.229999999999997 111.511 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 123' ' ' VAL . 0.2 OUTLIER -65.87 -53.57 38.05 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.428 -0.582 . . . . 54.130000000000003 109.428 178.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.659 . . . . 72.219999999999999 110.267 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 132' ' ' PRO . . . -61.67 -22.4 65.27 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.859 0.688 . . . . 54.329999999999998 112.859 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.3 -22.4 48.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.353 . . . . 63.409999999999997 111.907 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' A' ' 132' ' ' PRO . 90.0 mt -61.09 -47.78 94.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.947 0.721 . . . . 65.129999999999995 112.947 -177.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 129' ' ' ALA . 50.2 Cg_exo -56.62 -28.12 73.29 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.296 1.997 . . . . 51.109999999999999 112.743 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 51.6 ttp -81.68 -37.65 27.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.496 0.665 . . . . 75.349999999999994 110.092 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.5 -44.3 94.72 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.34 -0.845 . . . . 70.0 111.552 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.432 ' HB3' HD12 ' A' ' 145' ' ' LEU . 14.3 ptm180 -55.57 -33.8 64.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.259 -0.428 . . . . 75.230000000000004 111.308 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 16.2 m -57.79 -48.23 80.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.175 0.512 . . . . 71.409999999999997 110.157 177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' A' ' 52' ' ' PRO . 82.9 mm-40 -65.51 -47.17 76.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.6 -0.727 . . . . 73.120000000000005 111.291 -179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.4 mt -70.58 -51.2 30.0 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.293 0.849 . . . . 65.409999999999997 113.293 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.63 76.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.222 0.453 . . . . 62.340000000000003 112.222 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -82.39 14.01 3.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.312 0.577 . . . . 75.319999999999993 111.292 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 23.3 t -122.63 -14.11 7.82 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.705 -0.679 . . . . 62.020000000000003 109.833 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 124.23 -36.1 3.03 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.784 -0.722 . . . . 64.239999999999995 112.667 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 143' ' ' ILE . 4.4 mp -82.9 152.46 3.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 CA-C-O 120.961 0.41 . . . . 61.219999999999999 110.75 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.436 ' O ' ' HA ' ' A' ' 111' ' ' GLN . 48.8 mt-30 -137.45 135.19 36.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.387 -0.369 . . . . 71.430000000000007 110.274 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.432 HD12 ' HB3' ' A' ' 135' ' ' ARG . 78.2 mt -59.02 123.99 18.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.317 -0.401 . . . . 74.109999999999999 111.149 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -94.46 -91.59 1.66 Allowed Glycine 0 N--CA 1.439 -1.146 0 N-CA-C 110.991 -0.844 . . . . 54.539999999999999 110.991 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -104.36 166.99 10.04 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.67 -0.493 . . . . 73.109999999999999 109.67 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.3 m -145.49 140.36 27.47 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.9 -0.408 . . . . 74.010000000000005 109.9 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 115' ' ' GLN . 55.6 m -149.03 141.86 24.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.764 0.316 . . . . 51.219999999999999 110.567 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 66.8 mt -135.33 111.05 12.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.949 -0.76 . . . . 72.409999999999997 108.949 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 117' ' ' VAL . 22.9 t -110.4 133.02 53.67 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.924 0.392 . . . . 54.409999999999997 110.914 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.793 ' HA ' ' O ' ' A' ' 118' ' ' SER . 49.0 m -84.91 62.41 7.45 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.21 -0.45 . . . . 64.299999999999997 110.349 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 72.73 -48.06 0.68 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.067 0.947 . . . . 64.510000000000005 110.091 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.0 p -162.03 -173.08 3.5 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 107.958 -1.127 . . . . 74.319999999999993 107.958 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -110.29 101.4 10.15 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.937 -0.705 . . . . 74.230000000000004 110.922 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -168.3 91.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.258 -0.883 . . . . 63.409999999999997 109.942 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -146.97 54.02 0.54 Allowed Glycine 0 C--N 1.314 -0.648 0 C-N-CA 119.981 -1.104 . . . . 72.109999999999999 112.737 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -81.05 142.48 33.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.823 0.344 . . . . 73.430000000000007 110.914 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -160.2 129.45 5.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.101 -0.5 . . . . 73.209999999999994 110.217 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -88.44 96.97 10.81 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.275 -0.42 . . . . 64.530000000000001 110.439 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.5 m -77.37 137.99 39.05 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.459 -0.571 . . . . 75.109999999999999 109.459 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 46.5 t -167.61 163.17 14.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.727 0.299 . . . . 63.310000000000002 110.203 -177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.7 t -167.71 172.36 9.32 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.99 -0.744 . . . . 75.299999999999997 108.99 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -148.59 113.11 5.32 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.498 -0.556 . . . . 44.119999999999997 109.498 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -78.44 102.11 7.64 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.089 -0.505 . . . . 70.409999999999997 110.443 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -108.55 119.59 39.95 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.098 -0.501 . . . . 60.350000000000001 110.221 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 50.6 m -163.52 91.36 0.67 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.089 -0.505 . . . . 75.230000000000004 110.295 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 10.4 p -81.76 84.86 6.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.027 0.442 . . . . 54.329999999999998 110.604 178.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.394 -0.812 . . . . 75.430000000000007 110.458 -179.882 . . . . . . . . 0 0 . 1 stop_ save_