data_1z4h_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 1z4h _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 121.358 0.599 . . . . 2.6400000000000001 111.058 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.435 ' CD2' HG11 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.8 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.537 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.51 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.537 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.75 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.3200000000000001 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 1.02 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.769 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 2.4900000000000002 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.946 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 1.3899999999999999 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 2.3100000000000001 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.445 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 3.3700000000000001 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.419 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.96999999999999997 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.741 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 1.0900000000000001 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 2.4300000000000002 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 1.0600000000000001 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.3400000000000001 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.524 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.9199999999999999 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.60999999999999999 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.88 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.42999999999999999 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' HD11 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.7000000000000002 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.52000000000000002 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 1.04 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.482 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.98999999999999999 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64000000000000001 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.54 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.852 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 1.05 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.909 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 2.4500000000000002 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.445 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.3200000000000001 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.63 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.94999999999999996 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.5900000000000001 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.909 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.71999999999999997 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.6200000000000001 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.737 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 1.0800000000000001 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.537 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 2.2799999999999998 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 2.0600000000000001 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 2.3900000000000001 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.492 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.9900000000000002 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.55 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.492 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.5999999999999996 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.537 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 1.4199999999999999 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.6099999999999999 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.946 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.46000000000000002 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.411 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.97 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 1.1100000000000001 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.497 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.3300000000000001 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.591 ' HB3' HG22 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79000000000000004 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.832 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.39000000000000001 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 2.0600000000000001 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.57 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.3400000000000001 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.832 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.64000000000000001 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 2.1200000000000001 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.57 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 1.0 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.74 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 ' CD ' ' A' ' 30' ' ' ARG . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 1.25 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 2.1299999999999999 110.587 179.84 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.274 -0.639 . . . . 2.6400000000000001 109.274 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.8 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.557 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.51 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.614 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.75 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.3200000000000001 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 1.02 109.016 -177.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 2.4900000000000002 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 ' CE1' ' A' ' 53' ' ' HIS . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 1.3899999999999999 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 2.3100000000000001 111.155 178.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 3.3700000000000001 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.96999999999999997 110.642 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.79 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 1.0900000000000001 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 2.4300000000000002 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 1.0600000000000001 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.405 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.3400000000000001 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.901 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.9199999999999999 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.60999999999999999 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.88 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.42999999999999999 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.7000000000000002 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 1.0700000000000001 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.52000000000000002 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 1.04 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.98999999999999999 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64000000000000001 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' O ' ' HB3' ' A' ' 33' ' ' SER . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.54 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.53 HG22 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 1.05 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 2.4500000000000002 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.3200000000000001 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.63 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.94999999999999996 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.5900000000000001 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.71999999999999997 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.6200000000000001 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 1.0800000000000001 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 2.2799999999999998 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 2.0600000000000001 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 2.3900000000000001 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.43 ' C ' ' H ' ' A' ' 45' ' ' ARG . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.9900000000000002 111.363 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.55 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' H ' ' C ' ' A' ' 43' ' ' HIS . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.5999999999999996 109.225 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 1.4199999999999999 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.475 ' HD3' HD11 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.6099999999999999 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.767 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.46000000000000002 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.609 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.97 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.614 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 1.1100000000000001 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.596 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.3300000000000001 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.468 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79000000000000004 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.968 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.7 m170 -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.39000000000000001 109.371 175.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 2.0600000000000001 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.642 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.3400000000000001 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.968 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.64000000000000001 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 2.1200000000000001 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.642 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 1.0 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.74 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.444 HD23 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 1.25 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 2.1299999999999999 110.785 179.108 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.297 0.57 . . . . 2.6400000000000001 111.672 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.65 HD11 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.8 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.543 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.51 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.543 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.75 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.3200000000000001 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.65 ' HB3' HD11 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 1.02 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.546 HD21 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 2.4900000000000002 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.555 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 1.3899999999999999 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.485 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 2.3100000000000001 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 3.3700000000000001 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.96999999999999997 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.709 ' HB ' HD12 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 1.0900000000000001 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 2.4300000000000002 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 1.0600000000000001 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.3400000000000001 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.476 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.9199999999999999 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.60999999999999999 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.476 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.88 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.42999999999999999 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' HD13 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.7000000000000002 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 1.0700000000000001 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.52000000000000002 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.709 HD12 ' HB ' ' A' ' 16' ' ' ILE . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 1.04 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.99 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.98999999999999999 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64000000000000001 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.54 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.646 HG22 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 1.05 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 2.4500000000000002 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.3200000000000001 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.63 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.625 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.94999999999999996 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.5900000000000001 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.71999999999999997 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' HD11 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.6200000000000001 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.568 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 1.0800000000000001 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.7 ' HE3' HD12 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 2.2799999999999998 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.634 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 2.0600000000000001 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 2.3900000000000001 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.9900000000000002 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.55 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.99 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.5999999999999996 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 1.4199999999999999 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.546 HH11 HD21 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.6099999999999999 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.646 ' HE1' HG22 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.46000000000000002 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.7 HD12 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.97 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 1.1100000000000001 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HG3' ' N ' ' A' ' 52' ' ' ASP . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.3300000000000001 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79000000000000004 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.984 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.39000000000000001 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 2.0600000000000001 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.625 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.984 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.64000000000000001 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 2.1200000000000001 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 1.0 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.74 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.442 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 1.25 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 2.1299999999999999 110.813 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.113 0.482 . . . . 2.6400000000000001 109.996 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.632 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.8 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.583 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.51 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.583 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.75 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.3200000000000001 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 1.02 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.764 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 2.4900000000000002 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.648 HG23 ' CE1' ' A' ' 53' ' ' HIS . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 1.3899999999999999 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 2.3100000000000001 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 3.3700000000000001 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.96999999999999997 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 1.0900000000000001 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 2.4300000000000002 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 1.0600000000000001 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.3400000000000001 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.564 HG21 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.9199999999999999 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.60999999999999999 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.88 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.7000000000000002 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 1.0700000000000001 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.52000000000000002 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.466 HG12 HG22 ' A' ' 20' ' ' THR . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 1.04 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.98999999999999999 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64000000000000001 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.42 ' CD ' HD13 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.54 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.533 HG23 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 1.05 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 2.4500000000000002 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.3200000000000001 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.63 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.94999999999999996 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.5900000000000001 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.71999999999999997 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.576 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.6200000000000001 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 1.0800000000000001 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.592 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 2.2799999999999998 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 2.0600000000000001 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 2.3900000000000001 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.435 ' C ' ' H ' ' A' ' 45' ' ' ARG . 57.1 m170 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.9900000000000002 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.55 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.5999999999999996 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 1.4199999999999999 110.828 176.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.6099999999999999 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.827 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.46000000000000002 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.97 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 1.1100000000000001 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.576 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.3300000000000001 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79000000000000004 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.923 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.39000000000000001 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 2.0600000000000001 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.617 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.3400000000000001 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.923 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.64000000000000001 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 2.1200000000000001 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.617 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 1.0 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.74 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.42 HD13 ' CD ' ' A' ' 30' ' ' ARG . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 1.25 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 2.1299999999999999 109.425 175.581 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 120.775 0.321 . . . . 2.6400000000000001 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.8 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.544 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.51 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.75 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.3200000000000001 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 1.02 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 2.4900000000000002 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 53' ' ' HIS . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 1.3899999999999999 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.552 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 2.3100000000000001 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 3.3700000000000001 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.96999999999999997 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.679 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 1.0900000000000001 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 2.4300000000000002 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 1.0600000000000001 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.3400000000000001 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.695 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.9199999999999999 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.60999999999999999 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.695 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.88 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.42999999999999999 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' HD11 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.7000000000000002 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 1.0700000000000001 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.647 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.52000000000000002 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.536 HD11 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 1.04 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.98999999999999999 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64000000000000001 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.647 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.54 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.513 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 1.05 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.684 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 2.4500000000000002 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.3200000000000001 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.555 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.63 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.94999999999999996 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.5900000000000001 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.684 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.71999999999999997 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.456 ' O ' HD21 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.6200000000000001 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 1.0800000000000001 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 2.2799999999999998 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 2.0600000000000001 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 2.3900000000000001 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.9900000000000002 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.55 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.5999999999999996 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB3' HG21 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 1.4199999999999999 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.6099999999999999 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.61 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.46000000000000002 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.97 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 1.1100000000000001 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.3300000000000001 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.624 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79000000000000004 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.784 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 19.1 m170 -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.39000000000000001 110.104 177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 2.0600000000000001 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.3400000000000001 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.784 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.64000000000000001 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 2.1200000000000001 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.628 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.74 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.471 HD23 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 1.25 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 2.1299999999999999 110.984 179.553 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.068 0.461 . . . . 2.6400000000000001 111.229 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.667 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.8 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.51 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.75 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.3200000000000001 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 1.02 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.416 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 2.4900000000000002 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.667 HG13 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 1.3899999999999999 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.594 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.49 ' HG ' ' HE2' ' A' ' 17' ' ' MET . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 2.3100000000000001 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 3.3700000000000001 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.554 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.96999999999999997 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 1.0900000000000001 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.49 ' HE2' ' HG ' ' A' ' 13' ' ' LEU . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 2.4300000000000002 110.116 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 1.0600000000000001 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.3400000000000001 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.9199999999999999 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.60999999999999999 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.88 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.42999999999999999 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' HD13 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.7000000000000002 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 1.0700000000000001 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.52000000000000002 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HB ' ' A' ' 16' ' ' ILE . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 1.04 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.682 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.98999999999999999 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64000000000000001 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.54 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' ASP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 1.05 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 2.4500000000000002 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.3200000000000001 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.63 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.94999999999999996 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.5900000000000001 110.785 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD3' HG22 ' A' ' 31' ' ' ILE . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.71999999999999997 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.508 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.6200000000000001 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.725 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 1.0800000000000001 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.491 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 2.2799999999999998 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 2.0600000000000001 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.673 HG22 ' HD2' ' A' ' 43' ' ' HIS . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 2.3900000000000001 112.097 -175.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.673 ' HD2' HG22 ' A' ' 42' ' ' ILE . 8.6 p80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.9900000000000002 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.55 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.5999999999999996 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 1.4199999999999999 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.6099999999999999 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.46000000000000002 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.97 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 1.1100000000000001 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.6 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.3300000000000001 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.484 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79000000000000004 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.885 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.39000000000000001 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 2.0600000000000001 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.622 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.3400000000000001 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.885 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.64000000000000001 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 2.1200000000000001 110.54 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.622 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 1.0 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.74 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.472 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 1.25 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 2.1299999999999999 110.379 -177.429 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.6400000000000001 109.959 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 HG11 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.8 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.484 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.51 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.75 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.3200000000000001 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.406 ' HB3' HD23 ' A' ' 5' ' ' LEU . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 1.02 109.013 -175.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 2.4900000000000002 111.698 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.578 HG23 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 1.3899999999999999 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.467 HD11 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 2.3100000000000001 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.697 ' HA ' ' HE1' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 3.3700000000000001 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.96999999999999997 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.587 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 1.0900000000000001 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 2.4300000000000002 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 1.0600000000000001 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.9199999999999999 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.60999999999999999 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.88 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' HD11 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.7000000000000002 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 1.0700000000000001 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.619 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.52000000000000002 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.494 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 1.04 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.98999999999999999 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64000000000000001 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.54 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.643 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 1.05 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 2.4500000000000002 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.3200000000000001 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.63 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.94999999999999996 110.418 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.5900000000000001 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.71999999999999997 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.575 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.6200000000000001 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.858 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 1.0800000000000001 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 2.2799999999999998 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 2.0600000000000001 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 2.3900000000000001 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.9900000000000002 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.55 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.5999999999999996 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 1.4199999999999999 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.6099999999999999 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.661 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.46000000000000002 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.97 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 1.1100000000000001 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.678 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.3300000000000001 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79000000000000004 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.906 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.39000000000000001 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 2.0600000000000001 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.678 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.3400000000000001 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.906 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.64000000000000001 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 2.1200000000000001 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.665 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 1.0 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.74 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 1.25 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 2.1299999999999999 110.904 179.346 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.6400000000000001 109.959 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 HG11 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.8 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.484 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.51 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.75 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.3200000000000001 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.406 ' HB3' HD23 ' A' ' 5' ' ' LEU . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 1.02 109.013 -175.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 2.4900000000000002 111.698 -175.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.578 HG23 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 1.3899999999999999 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.467 HD11 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 2.3100000000000001 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.697 ' HA ' ' HE1' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 3.3700000000000001 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.96999999999999997 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.587 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 1.0900000000000001 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 2.4300000000000002 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 1.0600000000000001 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.9199999999999999 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.60999999999999999 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.88 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' HD11 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.7000000000000002 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 1.0700000000000001 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.619 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.52000000000000002 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.494 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 1.04 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.98999999999999999 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64000000000000001 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.54 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.643 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 1.05 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 2.4500000000000002 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.3200000000000001 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.63 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.94999999999999996 110.418 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.5900000000000001 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.71999999999999997 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.575 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.6200000000000001 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.858 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 1.0800000000000001 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 2.2799999999999998 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 2.0600000000000001 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 2.3900000000000001 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.9900000000000002 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.55 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.5999999999999996 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 1.4199999999999999 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.6099999999999999 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.661 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.46000000000000002 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.97 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 1.1100000000000001 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.678 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.3300000000000001 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79000000000000004 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.906 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.39000000000000001 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 2.0600000000000001 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.678 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.3400000000000001 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.906 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.64000000000000001 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 2.1200000000000001 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.665 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 1.0 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.74 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 1.25 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 2.1299999999999999 110.904 179.346 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.365 0.603 . . . . 2.6400000000000001 111.484 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.65 HD22 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.8 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.601 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.51 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.75 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.3200000000000001 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 1.02 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.705 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 2.4900000000000002 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 1.3899999999999999 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 2.3100000000000001 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 3.3700000000000001 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.495 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.96999999999999997 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.639 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 1.0900000000000001 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 2.4300000000000002 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 1.0600000000000001 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.3400000000000001 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.9199999999999999 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.60999999999999999 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.435 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.88 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.42999999999999999 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.7000000000000002 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 1.0700000000000001 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.52000000000000002 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 1.04 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.98999999999999999 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64000000000000001 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.462 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.54 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.616 HG23 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 1.05 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 2.4500000000000002 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.3200000000000001 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.559 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.63 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.702 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.94999999999999996 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.5900000000000001 113.401 168.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.41 ' CD ' ' HA ' ' A' ' 32' ' ' LYS . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.71999999999999997 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.632 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.6200000000000001 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HA ' HD12 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 1.0800000000000001 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 2.2799999999999998 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 2.0600000000000001 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 2.3900000000000001 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.9900000000000002 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.55 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.5999999999999996 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 1.4199999999999999 111.061 176.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.705 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.6099999999999999 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.779 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.46000000000000002 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.97 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 1.1100000000000001 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.502 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.3300000000000001 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79000000000000004 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.905 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.39000000000000001 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 2.0600000000000001 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.702 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.3400000000000001 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.928 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.64000000000000001 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 2.1200000000000001 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.596 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 1.0 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.928 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.74 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 1.25 111.849 -175.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp . . . . . 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 2.1299999999999999 110.512 177.982 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.066 0.46 . . . . 2.6400000000000001 111.735 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.651 HD23 HG11 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.8 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.49 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.51 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.75 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.3200000000000001 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 1.02 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.407 ' H ' HD21 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 2.4900000000000002 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.651 HG11 HD23 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 1.3899999999999999 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 2.3100000000000001 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.576 ' HA ' ' HE3' ' A' ' 17' ' ' MET . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 3.3700000000000001 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.96999999999999997 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.574 HG21 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 1.0900000000000001 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.576 ' HE3' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 2.4300000000000002 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 1.0600000000000001 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.3400000000000001 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.674 HG22 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.9199999999999999 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.60999999999999999 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.47 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.88 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.42999999999999999 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.7000000000000002 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 1.0700000000000001 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.677 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.52000000000000002 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.674 HG12 HG22 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 1.04 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.98999999999999999 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64000000000000001 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.677 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.54 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.854 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 1.05 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.876 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 2.4500000000000002 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.3200000000000001 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.63 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.94999999999999996 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.5900000000000001 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.876 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.71999999999999997 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.518 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.6200000000000001 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.76 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 1.0800000000000001 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HE2' HD12 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 2.2799999999999998 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 2.0600000000000001 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.674 HG21 ' HD2' ' A' ' 43' ' ' HIS . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 2.3900000000000001 110.044 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.674 ' HD2' HG21 ' A' ' 42' ' ' ILE . 53.6 m-70 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.9900000000000002 110.659 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.55 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.723 ' HD3' HD12 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.5999999999999996 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 1.4199999999999999 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.6099999999999999 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.76 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.46000000000000002 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HE2' ' A' ' 40' ' ' LYS . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.97 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 1.1100000000000001 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.518 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.3300000000000001 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.484 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79000000000000004 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.844 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.39000000000000001 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 2.0600000000000001 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.3400000000000001 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.844 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.64000000000000001 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 2.1200000000000001 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.528 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 1.0 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.74 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.47 HD11 ' HE1' ' A' ' 56' ' ' PHE . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 1.25 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 2.1299999999999999 110.844 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.668 -0.493 . . . . 2.6400000000000001 109.668 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.651 HD21 HG13 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.8 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.541 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.0 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.51 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.75 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.3200000000000001 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB3' HD23 ' A' ' 5' ' ' LEU . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 1.02 109.026 -177.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 2.4900000000000002 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.669 HG23 ' CE1' ' A' ' 53' ' ' HIS . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 1.3899999999999999 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.625 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 2.3100000000000001 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 3.3700000000000001 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.96999999999999997 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.676 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 2.4300000000000002 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 1.0600000000000001 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.3400000000000001 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.9199999999999999 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.60999999999999999 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.88 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.42999999999999999 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.7000000000000002 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 1.0700000000000001 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.456 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.52000000000000002 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.535 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 1.04 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.98999999999999999 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64000000000000001 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.456 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.54 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.5 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 1.05 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 2.4500000000000002 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.3200000000000001 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.63 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.753 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.94999999999999996 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.5900000000000001 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.402 ' HA ' ' CG ' ' A' ' 52' ' ' ASP . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.71999999999999997 113.453 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.6200000000000001 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.876 ' HA ' HD11 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 1.0800000000000001 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.505 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 2.2799999999999998 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.516 HG11 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 2.0600000000000001 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 2.3900000000000001 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' ARG . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.9900000000000002 110.233 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.55 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HA ' HG11 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.5999999999999996 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 1.4199999999999999 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.6099999999999999 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.77 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.46000000000000002 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.876 HD11 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.97 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 1.1100000000000001 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.681 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.3300000000000001 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.402 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79000000000000004 109.978 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.896 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.39000000000000001 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 2.0600000000000001 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.753 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.3400000000000001 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.896 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.64000000000000001 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 2.1200000000000001 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.692 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 1.0 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.74 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 1.25 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 2.1299999999999999 110.527 -179.517 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.515 -0.397 0 CA-C-O 121.103 0.478 . . . . 2.6400000000000001 110.279 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.8 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.4 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.51 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.75 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.3200000000000001 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 1.02 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 2.4900000000000002 111.609 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 1.3899999999999999 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.565 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.483 ' HG ' ' HE3' ' A' ' 17' ' ' MET . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 2.3100000000000001 111.451 -179.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 3.3700000000000001 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.96999999999999997 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 1.0900000000000001 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.483 ' HE3' ' HG ' ' A' ' 13' ' ' LEU . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 2.4300000000000002 110.615 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 1.0600000000000001 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.3400000000000001 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.501 HG21 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.9199999999999999 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.60999999999999999 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.88 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.42999999999999999 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.53 ' HA ' HD11 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.7000000000000002 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 1.0700000000000001 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.647 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.52000000000000002 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.53 HD11 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 1.04 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.98999999999999999 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64000000000000001 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.647 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.54 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 1.05 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 2.4500000000000002 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.3200000000000001 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.63 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.94999999999999996 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.5900000000000001 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.64 ' HG3' HG23 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.71999999999999997 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.6200000000000001 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.748 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 1.0800000000000001 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD13 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 2.2799999999999998 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 2.0600000000000001 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 2.3900000000000001 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.9900000000000002 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.55 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.5999999999999996 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 1.4199999999999999 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.6099999999999999 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.746 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.46000000000000002 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.748 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.97 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 1.1100000000000001 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.3300000000000001 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.446 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79000000000000004 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.875 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.39000000000000001 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 2.0600000000000001 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.57 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.3400000000000001 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.875 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.64000000000000001 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.64 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 2.1200000000000001 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.57 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 1.0 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.74 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.444 HD13 ' CD ' ' A' ' 30' ' ' ARG . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 1.25 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 2.1299999999999999 110.761 -179.27 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 108.958 -0.756 . . . . 2.6400000000000001 108.958 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.673 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.8 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.51 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.75 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.3200000000000001 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.673 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 1.02 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.461 HD11 ' HD2' ' A' ' 47' ' ' ARG . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 2.4900000000000002 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.51 HG23 ' CE1' ' A' ' 53' ' ' HIS . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 1.3899999999999999 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.702 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 2.3100000000000001 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 3.3700000000000001 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.96999999999999997 110.758 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.709 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 1.0900000000000001 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 2.4300000000000002 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 1.0600000000000001 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.3400000000000001 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.9199999999999999 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.60999999999999999 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.88 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.42999999999999999 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' HD11 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.7000000000000002 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 1.0700000000000001 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.485 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.52000000000000002 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 1.04 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.98999999999999999 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64000000000000001 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.485 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.54 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.866 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 1.05 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 2.4500000000000002 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.3200000000000001 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.63 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.94999999999999996 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.5900000000000001 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.866 ' HG3' HG23 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.71999999999999997 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.6200000000000001 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.794 ' HA ' HD11 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 1.0800000000000001 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.459 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 2.2799999999999998 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 2.0600000000000001 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 2.3900000000000001 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.524 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.9900000000000002 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.55 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.5999999999999996 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 1.4199999999999999 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.6099999999999999 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.687 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.46000000000000002 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.97 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 1.1100000000000001 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.412 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.3300000000000001 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79000000000000004 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.39000000000000001 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 2.0600000000000001 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.566 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.3400000000000001 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.64000000000000001 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 2.1200000000000001 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 1.0 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.493 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.74 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.434 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 1.25 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 2.1299999999999999 109.563 178.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 109.115 -0.698 . . . . 2.6400000000000001 109.115 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.8 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.568 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.51 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.568 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.75 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.3200000000000001 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 1.02 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 2.4900000000000002 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.593 HG22 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 1.3899999999999999 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.556 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 2.3100000000000001 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 3.3700000000000001 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.96999999999999997 110.649 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 1.0900000000000001 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 2.4300000000000002 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 1.0600000000000001 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.3400000000000001 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.9199999999999999 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.60999999999999999 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.88 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.42999999999999999 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HD11 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.7000000000000002 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 1.0700000000000001 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.485 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.52000000000000002 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.551 HD11 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 1.04 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.564 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.98999999999999999 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64000000000000001 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.649 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.54 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.807 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 1.05 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 2.4500000000000002 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.3200000000000001 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.63 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.551 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.94999999999999996 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.5900000000000001 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.71999999999999997 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.57 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.6200000000000001 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 1.0800000000000001 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.523 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 2.2799999999999998 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.661 HG22 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 2.0600000000000001 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 2.3900000000000001 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.9900000000000002 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.55 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.661 ' HA ' HG22 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.5999999999999996 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.4199999999999999 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.6099999999999999 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.808 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.46000000000000002 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.633 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.97 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 1.1100000000000001 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.633 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.3300000000000001 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.474 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79000000000000004 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.922 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.39000000000000001 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 2.0600000000000001 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.3400000000000001 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.922 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.64000000000000001 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 2.1200000000000001 110.573 172.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.496 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 1.0 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.649 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.74 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' CD ' ' A' ' 30' ' ' ARG . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 1.25 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 2.1299999999999999 110.912 179.134 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.708 0.29 . . . . 2.6400000000000001 110.544 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.643 HD23 HG11 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.8 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.593 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.51 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.593 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.75 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.3200000000000001 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.497 ' HB3' HD22 ' A' ' 5' ' ' LEU . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 1.02 108.584 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 2.4900000000000002 111.699 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.643 HG11 HD23 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 1.3899999999999999 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 2.3100000000000001 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 3.3700000000000001 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.96999999999999997 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.79 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 1.0900000000000001 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 2.4300000000000002 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 1.0600000000000001 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.478 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.3400000000000001 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.9199999999999999 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.60999999999999999 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.473 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.88 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.42999999999999999 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.7000000000000002 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 1.0700000000000001 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.5 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.52000000000000002 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 1.04 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.495 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.98999999999999999 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64000000000000001 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.54 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 1.05 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.681 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 2.4500000000000002 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.422 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.3200000000000001 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.63 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.94999999999999996 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.5900000000000001 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.821 ' HG3' HG23 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.71999999999999997 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.563 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.6200000000000001 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.832 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 1.0800000000000001 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.49 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 2.2799999999999998 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 2.0600000000000001 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 2.3900000000000001 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.9900000000000002 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.55 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.5999999999999996 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 1.4199999999999999 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.6099999999999999 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.753 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.46000000000000002 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.832 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.97 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 1.1100000000000001 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.3300000000000001 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.461 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79000000000000004 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.891 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.39000000000000001 109.29 176.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 2.0600000000000001 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.6 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.3400000000000001 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.891 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.64000000000000001 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 2.1200000000000001 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.6 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 1.0 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.74 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 1.25 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 2.1299999999999999 110.959 179.709 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.324 -0.621 . . . . 2.6400000000000001 109.324 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.582 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.8 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.555 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.51 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.563 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.75 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.3200000000000001 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.582 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 1.02 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 2.4900000000000002 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.494 HG22 ' CE1' ' A' ' 53' ' ' HIS . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 1.3899999999999999 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 2.3100000000000001 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 3.3700000000000001 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.96999999999999997 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.799 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 1.0900000000000001 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 2.4300000000000002 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 1.0600000000000001 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.3400000000000001 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.9199999999999999 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.60999999999999999 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.88 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.42999999999999999 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HA ' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.7000000000000002 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 1.0700000000000001 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.563 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.52000000000000002 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 1.04 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.445 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.98999999999999999 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64000000000000001 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.563 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.54 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.719 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 1.05 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.66 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 2.4500000000000002 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.3200000000000001 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.63 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.94999999999999996 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.5900000000000001 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.719 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.71999999999999997 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.582 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.6200000000000001 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 1.0800000000000001 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.568 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 2.2799999999999998 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 2.0600000000000001 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 2.3900000000000001 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.505 ' C ' ' H ' ' A' ' 45' ' ' ARG . 88.7 m-70 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.9900000000000002 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.55 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.505 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.5999999999999996 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 1.4199999999999999 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.6099999999999999 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.843 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.46000000000000002 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.97 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.563 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 1.1100000000000001 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.582 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.3300000000000001 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.496 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79000000000000004 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.834 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.39000000000000001 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 2.0600000000000001 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.3400000000000001 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.64000000000000001 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 2.1200000000000001 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.588 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.499 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.74 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 HD22 ' HD3' ' A' ' 30' ' ' ARG . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 1.25 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 2.1299999999999999 110.337 177.4 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.009 -0.738 . . . . 2.6400000000000001 109.009 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.859 HD13 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.8 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.601 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 3.4 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.51 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.75 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.3200000000000001 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.859 ' HB3' HD13 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 1.02 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.612 HD12 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 2.4900000000000002 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.826 HG11 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 1.3899999999999999 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.618 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 2.3100000000000001 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.588 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 3.3700000000000001 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.96999999999999997 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 1.0900000000000001 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 2.4300000000000002 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 1.0600000000000001 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.3400000000000001 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.9199999999999999 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.60999999999999999 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.88 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.42999999999999999 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.7000000000000002 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 1.0700000000000001 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.523 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.52000000000000002 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.482 HG22 HG23 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 1.04 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.416 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.98999999999999999 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64000000000000001 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.615 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.54 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.581 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 1.05 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 2.4500000000000002 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.601 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.3200000000000001 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.63 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.94999999999999996 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.5900000000000001 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.53 ' HD3' HG23 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.71999999999999997 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.629 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.6200000000000001 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 1.0800000000000001 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.584 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 2.2799999999999998 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 2.0600000000000001 110.135 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 2.3900000000000001 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.424 ' C ' ' H ' ' A' ' 45' ' ' ARG . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.9900000000000002 111.525 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.55 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.424 ' H ' ' C ' ' A' ' 43' ' ' HIS . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.5999999999999996 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 45' ' ' ARG . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 1.4199999999999999 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.612 ' HD3' HD12 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.6099999999999999 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.657 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.46000000000000002 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.97 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.423 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 1.1100000000000001 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.3300000000000001 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79000000000000004 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.892 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.39000000000000001 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 2.0600000000000001 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.3400000000000001 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.892 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.64000000000000001 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 2.1200000000000001 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.654 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 1.0 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.74 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.441 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 1.25 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 2.1299999999999999 110.29 177.623 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 120.822 0.344 . . . . 5.6500000000000004 110.613 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.504 ' OE1' ' HA ' ' A' ' 2' ' ' GLN . 9.1 mm-40 -80.72 96.36 6.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.139 0.495 . . . . 5.1600000000000001 110.237 176.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -107.03 127.29 53.33 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.742 -0.663 . . . . 4.0800000000000001 109.638 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -102.99 140.24 37.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 2.6400000000000001 111.058 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.435 ' CD2' HG11 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.8 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.537 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.51 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.537 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.75 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.3200000000000001 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 1.02 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.769 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 2.4900000000000002 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.946 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 1.3899999999999999 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 2.3100000000000001 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.445 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 3.3700000000000001 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.419 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.96999999999999997 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.741 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 1.0900000000000001 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 2.4300000000000002 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 1.0600000000000001 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.3400000000000001 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.524 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.9199999999999999 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.60999999999999999 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.88 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.42999999999999999 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' HD11 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.7000000000000002 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.52000000000000002 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 1.04 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.482 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.98999999999999999 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64000000000000001 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.54 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.852 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 1.05 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.909 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 2.4500000000000002 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.445 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.3200000000000001 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.63 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.94999999999999996 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.5900000000000001 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.909 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.71999999999999997 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.6200000000000001 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.737 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 1.0800000000000001 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.537 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 2.2799999999999998 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 2.0600000000000001 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 2.3900000000000001 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.492 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.9900000000000002 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.55 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.492 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.5999999999999996 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.537 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 1.4199999999999999 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.6099999999999999 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.946 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.46000000000000002 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.411 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.97 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 1.1100000000000001 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.497 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.3300000000000001 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.591 ' HB3' HG22 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79000000000000004 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.832 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.39000000000000001 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 2.0600000000000001 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.57 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.3400000000000001 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.832 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.64000000000000001 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 2.1200000000000001 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.57 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 1.0 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.74 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 ' CD ' ' A' ' 30' ' ' ARG . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 1.25 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.86 -31.57 72.26 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 2.1299999999999999 110.587 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.7 t -72.01 -42.06 66.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.586 -0.734 . . . . 2.2400000000000002 110.706 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -84.86 -17.87 36.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.382 -0.372 . . . . 6.8300000000000001 111.452 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 59.68 73.35 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.81 -0.632 . . . . 3.75 110.969 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -74.32 139.96 44.55 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.189 0.518 . . . . 4.5 110.658 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.525 -1.153 . . . . 6.8799999999999999 111.461 -179.278 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.774 ' SD ' ' HG2' ' A' ' 2' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 109.359 -0.608 . . . . 5.6500000000000004 109.359 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.774 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 19.4 pt20 172.82 -36.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.601 -0.889 . . . . 5.1600000000000001 108.601 175.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -104.29 102.41 12.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.397 -0.964 . . . . 4.0800000000000001 108.397 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -105.02 137.36 42.9 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.274 -0.639 . . . . 2.6400000000000001 109.274 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.8 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.557 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.51 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.614 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.75 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.3200000000000001 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 1.02 109.016 -177.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 2.4900000000000002 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 ' CE1' ' A' ' 53' ' ' HIS . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 1.3899999999999999 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 2.3100000000000001 111.155 178.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 3.3700000000000001 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.96999999999999997 110.642 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.79 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 1.0900000000000001 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 2.4300000000000002 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 1.0600000000000001 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.405 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.3400000000000001 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.901 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.9199999999999999 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.60999999999999999 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.88 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.42999999999999999 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.7000000000000002 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 1.0700000000000001 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.52000000000000002 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 1.04 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.98999999999999999 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64000000000000001 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' O ' ' HB3' ' A' ' 33' ' ' SER . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.54 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.53 HG22 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 1.05 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 2.4500000000000002 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.3200000000000001 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.63 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.94999999999999996 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.5900000000000001 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.71999999999999997 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.6200000000000001 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 1.0800000000000001 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 2.2799999999999998 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 2.0600000000000001 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 2.3900000000000001 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.43 ' C ' ' H ' ' A' ' 45' ' ' ARG . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.9900000000000002 111.363 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.55 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' H ' ' C ' ' A' ' 43' ' ' HIS . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.5999999999999996 109.225 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 1.4199999999999999 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.475 ' HD3' HD11 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.6099999999999999 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.767 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.46000000000000002 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.609 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.97 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.614 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 1.1100000000000001 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.596 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.3300000000000001 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.468 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79000000000000004 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.968 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.7 m170 -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.39000000000000001 109.371 175.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 2.0600000000000001 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.642 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.3400000000000001 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.968 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.64000000000000001 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 2.1200000000000001 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.642 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 1.0 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.74 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.444 HD23 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 1.25 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp -66.78 -37.56 84.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 2.1299999999999999 110.785 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.2 t -58.21 -38.27 76.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.715 -0.675 . . . . 2.2400000000000002 110.896 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -94.68 -96.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.479 -0.328 . . . . 6.8300000000000001 111.46 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -169.13 50.57 0.04 OUTLIER 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.631 -0.507 . . . . 3.75 109.631 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.6 43.39 12.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.137 -0.938 . . . . 4.5 109.223 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 CA-C-O 117.987 -1.452 . . . . 6.8799999999999999 110.652 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.908 0.385 . . . . 5.6500000000000004 110.603 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -74.78 144.33 43.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.58 -0.526 . . . . 5.1600000000000001 109.58 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -104.35 134.59 47.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.244 -0.434 . . . . 4.0800000000000001 110.507 -173.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -116.89 133.95 55.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.297 0.57 . . . . 2.6400000000000001 111.672 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.65 HD11 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.8 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.543 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.51 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.543 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.75 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.3200000000000001 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.65 ' HB3' HD11 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 1.02 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.546 HD21 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 2.4900000000000002 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.555 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 1.3899999999999999 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.485 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 2.3100000000000001 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 3.3700000000000001 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.96999999999999997 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.709 ' HB ' HD12 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 1.0900000000000001 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 2.4300000000000002 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 1.0600000000000001 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.3400000000000001 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.476 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.9199999999999999 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.60999999999999999 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.476 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.88 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.42999999999999999 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' HD13 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.7000000000000002 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 1.0700000000000001 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.52000000000000002 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.709 HD12 ' HB ' ' A' ' 16' ' ' ILE . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 1.04 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.99 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.98999999999999999 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64000000000000001 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.54 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.646 HG22 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 1.05 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 2.4500000000000002 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.3200000000000001 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.63 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.625 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.94999999999999996 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.5900000000000001 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.71999999999999997 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' HD11 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.6200000000000001 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.568 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 1.0800000000000001 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.7 ' HE3' HD12 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 2.2799999999999998 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.634 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 2.0600000000000001 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 2.3900000000000001 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.9900000000000002 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.55 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.99 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.5999999999999996 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 1.4199999999999999 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.546 HH11 HD21 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.6099999999999999 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.646 ' HE1' HG22 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.46000000000000002 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.7 HD12 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.97 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 1.1100000000000001 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HG3' ' N ' ' A' ' 52' ' ' ASP . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.3300000000000001 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79000000000000004 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.984 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.39000000000000001 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 2.0600000000000001 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.625 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.984 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.64000000000000001 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 2.1200000000000001 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 1.0 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.74 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.442 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 1.25 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp -75.23 -47.21 29.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 2.1299999999999999 110.813 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.0 m -76.85 -40.22 48.49 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.082 -0.508 . . . . 2.2400000000000002 111.213 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -117.99 78.81 1.28 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.497 -0.556 . . . . 6.8300000000000001 109.497 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.88 100.01 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.694 -0.685 . . . . 3.75 111.944 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -125.86 15.15 8.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.398 0.618 . . . . 4.5 109.68 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 CA-C-O 118.817 -0.991 . . . . 6.8799999999999999 110.938 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 tpp . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.718 0.294 . . . . 5.6500000000000004 110.927 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -79.99 132.12 35.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.172 0.51 . . . . 5.1600000000000001 111.377 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -118.81 121.36 39.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 4.0800000000000001 110.025 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -103.56 105.34 15.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.113 0.482 . . . . 2.6400000000000001 109.996 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.632 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.8 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.583 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.51 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.583 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.75 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.3200000000000001 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 1.02 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.764 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 2.4900000000000002 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.648 HG23 ' CE1' ' A' ' 53' ' ' HIS . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 1.3899999999999999 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 2.3100000000000001 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 3.3700000000000001 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.96999999999999997 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 1.0900000000000001 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 2.4300000000000002 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 1.0600000000000001 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.3400000000000001 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.564 HG21 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.9199999999999999 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.60999999999999999 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.88 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.7000000000000002 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 1.0700000000000001 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.52000000000000002 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.466 HG12 HG22 ' A' ' 20' ' ' THR . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 1.04 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.98999999999999999 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64000000000000001 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.42 ' CD ' HD13 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.54 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.533 HG23 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 1.05 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 2.4500000000000002 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.3200000000000001 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.63 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.94999999999999996 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.5900000000000001 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.71999999999999997 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.576 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.6200000000000001 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 1.0800000000000001 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.592 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 2.2799999999999998 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 2.0600000000000001 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 2.3900000000000001 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.435 ' C ' ' H ' ' A' ' 45' ' ' ARG . 57.1 m170 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.9900000000000002 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.55 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.5999999999999996 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 1.4199999999999999 110.828 176.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.6099999999999999 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.827 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.46000000000000002 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.97 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 1.1100000000000001 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.576 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.3300000000000001 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79000000000000004 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.923 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.39000000000000001 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 2.0600000000000001 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.617 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.3400000000000001 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.923 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.64000000000000001 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 2.1200000000000001 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.617 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 1.0 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.74 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.444 HD22 HD22 ' A' ' 65' ' ' ASN . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 1.25 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.5 -32.8 70.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 2.1299999999999999 109.425 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -84.71 -9.01 58.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.236 -0.893 . . . . 2.2400000000000002 110.495 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 44.57 40.92 4.35 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.808 -1.087 . . . . 6.8300000000000001 112.796 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 60.58 1.38 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.149 0.5 . . . . 3.75 110.661 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.444 HD22 HD22 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -149.41 27.78 0.82 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 4.5 110.395 -179.355 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.797 -1.002 . . . . 6.8799999999999999 111.437 -179.669 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 5.6500000000000004 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -139.31 143.95 38.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.456 -0.338 . . . . 5.1600000000000001 110.759 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -104.16 104.63 14.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.147 -0.479 . . . . 4.0800000000000001 110.055 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -104.49 145.06 30.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.775 0.321 . . . . 2.6400000000000001 110.141 174.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.8 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.544 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.51 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.75 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.3200000000000001 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 1.02 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 2.4900000000000002 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 53' ' ' HIS . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 1.3899999999999999 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.552 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 2.3100000000000001 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 3.3700000000000001 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.96999999999999997 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.679 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 1.0900000000000001 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 2.4300000000000002 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 1.0600000000000001 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.3400000000000001 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.695 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.9199999999999999 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.60999999999999999 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.695 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.88 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.42999999999999999 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' HD11 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.7000000000000002 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 1.0700000000000001 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.647 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.52000000000000002 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.536 HD11 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 1.04 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.98999999999999999 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64000000000000001 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.647 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.54 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.513 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 1.05 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.684 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 2.4500000000000002 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.3200000000000001 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.555 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.63 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.94999999999999996 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.5900000000000001 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.684 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.71999999999999997 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.456 ' O ' HD21 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.6200000000000001 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 1.0800000000000001 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 2.2799999999999998 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 2.0600000000000001 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 2.3900000000000001 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.9900000000000002 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.55 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.5999999999999996 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB3' HG21 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 1.4199999999999999 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.6099999999999999 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.61 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.46000000000000002 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.97 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 1.1100000000000001 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.3300000000000001 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.624 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79000000000000004 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.784 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 19.1 m170 -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.39000000000000001 110.104 177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 2.0600000000000001 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.3400000000000001 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.784 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.64000000000000001 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 2.1200000000000001 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.628 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.74 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.471 HD23 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 1.25 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp -72.02 -42.12 66.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 2.1299999999999999 110.984 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.2 t -74.15 -51.38 15.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 2.2400000000000002 111.802 -177.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -100.9 -16.15 17.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.226 0.454 . . . . 6.8300000000000001 112.226 -171.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 52.46 79.79 0.11 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.022 0.439 . . . . 3.75 111.882 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -126.18 172.78 9.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 4.5 110.425 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.192 0 CA-C-O 118.658 -1.079 . . . . 6.8799999999999999 111.921 -179.606 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mmm . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.709 0.29 . . . . 5.6500000000000004 110.616 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -166.56 108.63 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.802 0.334 . . . . 5.1600000000000001 110.378 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -108.76 120.47 42.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.227 -0.657 . . . . 4.0800000000000001 109.227 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -103.23 134.76 46.1 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.068 0.461 . . . . 2.6400000000000001 111.229 -175.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.667 ' CD2' HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.8 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.51 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.75 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.3200000000000001 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 1.02 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.416 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 2.4900000000000002 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.667 HG13 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 1.3899999999999999 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.594 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.49 ' HG ' ' HE2' ' A' ' 17' ' ' MET . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 2.3100000000000001 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 3.3700000000000001 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.554 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.96999999999999997 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 1.0900000000000001 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.49 ' HE2' ' HG ' ' A' ' 13' ' ' LEU . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 2.4300000000000002 110.116 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 1.0600000000000001 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.3400000000000001 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.9199999999999999 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.60999999999999999 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.88 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.42999999999999999 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' HD13 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.7000000000000002 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 1.0700000000000001 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.52000000000000002 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HB ' ' A' ' 16' ' ' ILE . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 1.04 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.682 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.98999999999999999 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64000000000000001 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.54 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' ASP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 1.05 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 2.4500000000000002 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.3200000000000001 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.63 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.94999999999999996 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.5900000000000001 110.785 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD3' HG22 ' A' ' 31' ' ' ILE . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.71999999999999997 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.508 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.6200000000000001 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.725 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 1.0800000000000001 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.491 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 2.2799999999999998 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 2.0600000000000001 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.673 HG22 ' HD2' ' A' ' 43' ' ' HIS . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 2.3900000000000001 112.097 -175.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.673 ' HD2' HG22 ' A' ' 42' ' ' ILE . 8.6 p80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.9900000000000002 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.55 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.5999999999999996 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 1.4199999999999999 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.6099999999999999 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.46000000000000002 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.97 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 1.1100000000000001 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.6 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.3300000000000001 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79000000000000004 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.885 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.39000000000000001 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 2.0600000000000001 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.622 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.3400000000000001 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.885 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.64000000000000001 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 2.1200000000000001 110.54 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.622 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 1.0 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.74 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.472 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 1.25 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.8 -58.75 7.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 2.1299999999999999 110.379 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.8 p -81.93 -32.6 30.78 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.149 -0.932 . . . . 2.2400000000000002 111.3 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -126.15 88.19 2.8 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.771 -0.65 . . . . 6.8300000000000001 111.221 -172.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 92.46 0.13 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.727 -0.669 . . . . 3.75 110.471 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -50.91 46.95 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.081 -0.508 . . . . 4.5 111.344 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.661 -1.077 . . . . 6.8799999999999999 111.156 -173.933 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.6500000000000004 110.759 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 5.1600000000000001 108.994 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 4.0800000000000001 110.086 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.6400000000000001 109.959 174.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 HG11 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.8 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.484 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.51 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.75 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.3200000000000001 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.406 ' HB3' HD23 ' A' ' 5' ' ' LEU . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 1.02 109.013 -175.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 2.4900000000000002 111.698 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.578 HG23 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 1.3899999999999999 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.467 HD11 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 2.3100000000000001 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.697 ' HA ' ' HE1' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 3.3700000000000001 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.96999999999999997 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.587 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 1.0900000000000001 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 2.4300000000000002 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 1.0600000000000001 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.9199999999999999 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.60999999999999999 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.88 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' HD11 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.7000000000000002 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 1.0700000000000001 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.619 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.52000000000000002 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.494 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 1.04 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.98999999999999999 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64000000000000001 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.54 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.643 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 1.05 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 2.4500000000000002 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.3200000000000001 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.63 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.94999999999999996 110.418 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.5900000000000001 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.71999999999999997 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.575 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.6200000000000001 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.858 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 1.0800000000000001 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 2.2799999999999998 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 2.0600000000000001 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 2.3900000000000001 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.9900000000000002 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.55 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.5999999999999996 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 1.4199999999999999 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.6099999999999999 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.661 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.46000000000000002 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.97 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 1.1100000000000001 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.678 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.3300000000000001 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79000000000000004 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.906 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.39000000000000001 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 2.0600000000000001 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.678 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.3400000000000001 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.906 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.64000000000000001 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 2.1200000000000001 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.665 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 1.0 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.74 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 1.25 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 2.1299999999999999 110.904 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 111.1 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.8300000000000001 111.632 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.8799999999999999 111.816 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.6500000000000004 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 5.1600000000000001 108.994 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 4.0800000000000001 110.086 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.6400000000000001 109.959 174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 HG11 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.8 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.484 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.51 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.75 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.3200000000000001 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.406 ' HB3' HD23 ' A' ' 5' ' ' LEU . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 1.02 109.013 -175.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 2.4900000000000002 111.698 -175.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.578 HG23 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 1.3899999999999999 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.467 HD11 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 2.3100000000000001 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.697 ' HA ' ' HE1' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 3.3700000000000001 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.96999999999999997 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.587 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 1.0900000000000001 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 2.4300000000000002 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 1.0600000000000001 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.3400000000000001 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.719 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.9199999999999999 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.60999999999999999 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.88 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.42999999999999999 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' HD11 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.7000000000000002 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 1.0700000000000001 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.619 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.52000000000000002 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.494 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 1.04 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.98999999999999999 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64000000000000001 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.54 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.643 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 1.05 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 2.4500000000000002 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.3200000000000001 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.63 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.94999999999999996 110.418 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.5900000000000001 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.71999999999999997 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.575 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.6200000000000001 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.858 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 1.0800000000000001 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 2.2799999999999998 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 2.0600000000000001 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 2.3900000000000001 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.9900000000000002 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.55 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.5999999999999996 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 1.4199999999999999 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.6099999999999999 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.661 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.46000000000000002 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.97 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 1.1100000000000001 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.678 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.3300000000000001 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79000000000000004 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.906 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.39000000000000001 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 2.0600000000000001 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.678 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.3400000000000001 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.906 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.64000000000000001 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 2.1200000000000001 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.665 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 1.0 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.74 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 1.25 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 2.1299999999999999 110.904 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 111.1 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.8300000000000001 111.632 -175.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.8799999999999999 111.816 177.443 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.231 0.539 . . . . 5.6500000000000004 110.032 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -106.88 144.58 33.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.948 -0.569 . . . . 5.1600000000000001 110.427 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -103.34 114.02 27.96 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.741 -0.837 . . . . 4.0800000000000001 108.741 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -103.31 135.81 44.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.365 0.603 . . . . 2.6400000000000001 111.484 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.65 HD22 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.8 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.601 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.51 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.75 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.3200000000000001 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 1.02 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.705 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 2.4900000000000002 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 1.3899999999999999 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 2.3100000000000001 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 3.3700000000000001 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.495 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.96999999999999997 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.639 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 1.0900000000000001 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 2.4300000000000002 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 1.0600000000000001 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.3400000000000001 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.9199999999999999 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.60999999999999999 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.435 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.88 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.42999999999999999 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.7000000000000002 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 1.0700000000000001 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.52000000000000002 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 1.04 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.98999999999999999 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64000000000000001 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.462 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.54 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.616 HG23 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 1.05 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 2.4500000000000002 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.3200000000000001 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.559 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.63 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.702 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.94999999999999996 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.5900000000000001 113.401 168.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.41 ' CD ' ' HA ' ' A' ' 32' ' ' LYS . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.71999999999999997 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.632 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.6200000000000001 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HA ' HD12 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 1.0800000000000001 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 2.2799999999999998 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 2.0600000000000001 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 2.3900000000000001 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.9900000000000002 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.55 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.5999999999999996 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 1.4199999999999999 111.061 176.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.705 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.6099999999999999 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.779 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.46000000000000002 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.97 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 1.1100000000000001 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.502 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.3300000000000001 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79000000000000004 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.905 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.39000000000000001 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 2.0600000000000001 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.702 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.3400000000000001 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.928 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.64000000000000001 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 2.1200000000000001 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.596 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 1.0 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.928 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.74 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.456 HD23 ' H ' ' A' ' 65' ' ' ASN . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 1.25 111.849 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp -79.12 -37.07 39.52 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 2.1299999999999999 110.512 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.0 p -86.4 -51.4 6.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.888 -0.596 . . . . 2.2400000000000002 111.856 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -108.25 -5.66 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.361 0.504 . . . . 6.8300000000000001 112.361 -173.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 47.94 73.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.138 0.494 . . . . 3.75 112.275 175.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.456 ' H ' HD23 ' A' ' 60' ' ' LEU . 31.3 m-80 -91.54 -165.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 4.5 110.111 -177.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.42 -1.211 . . . . 6.8799999999999999 112.316 176.088 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 tpp . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 109.565 -0.531 . . . . 5.6500000000000004 109.565 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -76.15 53.18 0.78 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.871 0.693 . . . . 5.1600000000000001 112.871 -172.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -144.14 133.52 23.25 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.508 -0.923 . . . . 4.0800000000000001 108.508 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.58 157.77 22.59 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.066 0.46 . . . . 2.6400000000000001 111.735 -167.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.651 HD23 HG11 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.8 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.49 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.51 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.75 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.3200000000000001 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 1.02 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.407 ' H ' HD21 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 2.4900000000000002 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.651 HG11 HD23 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 1.3899999999999999 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 2.3100000000000001 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.576 ' HA ' ' HE3' ' A' ' 17' ' ' MET . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 3.3700000000000001 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.96999999999999997 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.574 HG21 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 1.0900000000000001 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.576 ' HE3' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 2.4300000000000002 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 1.0600000000000001 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.3400000000000001 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.674 HG22 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.9199999999999999 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.60999999999999999 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.511 ' HE1' HD22 ' A' ' 65' ' ' ASN . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.88 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.42999999999999999 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.7000000000000002 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 1.0700000000000001 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.677 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.52000000000000002 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.674 HG12 HG22 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 1.04 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.98999999999999999 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64000000000000001 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.677 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.54 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.854 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 1.05 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.876 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 2.4500000000000002 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.3200000000000001 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.63 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.94999999999999996 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.5900000000000001 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.876 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.71999999999999997 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.518 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.6200000000000001 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.76 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 1.0800000000000001 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HE2' HD12 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 2.2799999999999998 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 2.0600000000000001 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.674 HG21 ' HD2' ' A' ' 43' ' ' HIS . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 2.3900000000000001 110.044 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.674 ' HD2' HG21 ' A' ' 42' ' ' ILE . 53.6 m-70 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.9900000000000002 110.659 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.55 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.723 ' HD3' HD12 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.5999999999999996 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 1.4199999999999999 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.6099999999999999 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.76 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.46000000000000002 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HE2' ' A' ' 40' ' ' LYS . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.97 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 1.1100000000000001 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.518 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.3300000000000001 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79000000000000004 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.844 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.39000000000000001 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 2.0600000000000001 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.3400000000000001 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.844 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.64000000000000001 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 2.1200000000000001 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.528 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 1.0 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.74 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.942 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 1.25 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp -63.12 -41.75 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 2.1299999999999999 110.844 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.2 p -74.51 -9.36 58.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.869 -0.605 . . . . 2.2400000000000002 111.022 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -98.26 -81.49 0.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.416 -0.357 . . . . 6.8300000000000001 110.702 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -171.22 29.89 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.534 -0.303 . . . . 3.75 111.636 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.942 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 48.3 t-20 -140.15 94.43 2.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 4.5 110.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.022 -1.432 . . . . 6.8799999999999999 111.278 177.488 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.172 0.51 . . . . 5.6500000000000004 109.83 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -97.22 -16.16 20.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.868 -0.606 . . . . 5.1600000000000001 110.6 -173.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -119.7 131.28 55.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 4.0800000000000001 110.859 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.59 166.26 10.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.668 -0.493 . . . . 2.6400000000000001 109.668 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.651 HD21 HG13 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.8 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.541 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.0 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.51 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.75 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.3200000000000001 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB3' HD23 ' A' ' 5' ' ' LEU . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 1.02 109.026 -177.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 2.4900000000000002 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.669 HG23 ' CE1' ' A' ' 53' ' ' HIS . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 1.3899999999999999 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.625 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 2.3100000000000001 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 3.3700000000000001 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.96999999999999997 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.676 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 2.4300000000000002 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 1.0600000000000001 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.3400000000000001 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.9199999999999999 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.60999999999999999 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.88 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.42999999999999999 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.7000000000000002 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 1.0700000000000001 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.456 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.52000000000000002 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.535 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 1.04 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.98999999999999999 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64000000000000001 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.456 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.54 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.5 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 1.05 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 2.4500000000000002 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.3200000000000001 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.63 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.753 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.94999999999999996 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.5900000000000001 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.402 ' HA ' ' CG ' ' A' ' 52' ' ' ASP . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.71999999999999997 113.453 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.6200000000000001 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.876 ' HA ' HD11 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 1.0800000000000001 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.505 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 2.2799999999999998 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.516 HG11 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 2.0600000000000001 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 2.3900000000000001 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' ARG . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.9900000000000002 110.233 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.55 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HA ' HG11 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.5999999999999996 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 1.4199999999999999 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.6099999999999999 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.77 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.46000000000000002 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.876 HD11 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.97 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 1.1100000000000001 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.681 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.3300000000000001 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.402 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79000000000000004 109.978 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.896 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.39000000000000001 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 2.0600000000000001 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.753 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.3400000000000001 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.896 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.64000000000000001 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 2.1200000000000001 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.692 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 1.0 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.74 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 1.25 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp -65.4 -36.01 82.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 2.1299999999999999 110.527 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -78.5 -7.35 57.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.749 -0.659 . . . . 2.2400000000000002 110.822 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 51.91 37.51 21.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.013 -0.994 . . . . 6.8300000000000001 112.069 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -98.87 36.0 1.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.484 0.659 . . . . 3.75 109.828 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.8 72.15 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.416 -0.811 . . . . 4.5 110.398 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.76 -1.022 . . . . 6.8799999999999999 111.833 179.183 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 tmm? . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.028 -0.36 . . . . 5.6500000000000004 110.028 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.05 137.67 58.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.488 . . . . 5.1600000000000001 111.303 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -104.17 104.73 14.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.051 -1.092 . . . . 4.0800000000000001 108.051 174.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -101.08 103.66 14.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.103 0.478 . . . . 2.6400000000000001 110.279 -171.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.8 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.4 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.51 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.75 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.3200000000000001 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 1.02 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 2.4900000000000002 111.609 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 1.3899999999999999 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.565 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.483 ' HG ' ' HE3' ' A' ' 17' ' ' MET . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 2.3100000000000001 111.451 -179.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 3.3700000000000001 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.96999999999999997 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 1.0900000000000001 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.483 ' HE3' ' HG ' ' A' ' 13' ' ' LEU . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 2.4300000000000002 110.615 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 1.0600000000000001 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.3400000000000001 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.501 HG21 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.9199999999999999 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.60999999999999999 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.88 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.42999999999999999 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.53 ' HA ' HD11 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.7000000000000002 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 1.0700000000000001 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.647 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.52000000000000002 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.53 HD11 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 1.04 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.98999999999999999 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64000000000000001 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.647 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.54 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 1.05 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 2.4500000000000002 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.3200000000000001 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.63 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.94999999999999996 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.5900000000000001 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.64 ' HG3' HG23 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.71999999999999997 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.6200000000000001 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.748 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 1.0800000000000001 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD13 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 2.2799999999999998 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 2.0600000000000001 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 2.3900000000000001 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.9900000000000002 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.55 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.5999999999999996 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 1.4199999999999999 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.6099999999999999 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.746 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.46000000000000002 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.748 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.97 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 1.1100000000000001 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.3300000000000001 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.446 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79000000000000004 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.875 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.39000000000000001 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 2.0600000000000001 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.57 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.3400000000000001 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.875 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.64000000000000001 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.64 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 2.1200000000000001 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.57 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 1.0 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.74 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.492 ' O ' ' HA ' ' A' ' 64' ' ' ALA . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 1.25 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp -82.91 -46.35 13.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 2.1299999999999999 110.761 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t -74.33 -50.11 20.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 2.2400000000000002 110.575 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.6 mtt180 -80.49 -21.5 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.344 -0.389 . . . . 6.8300000000000001 111.086 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 46.72 65.53 1.19 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.527 0.517 . . . . 3.75 111.801 175.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -112.0 72.89 0.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.71 0.767 . . . . 4.5 110.856 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-N 115.355 -0.839 . . . . 6.8799999999999999 111.118 179.22 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.778 0.323 . . . . 5.6500000000000004 110.527 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -150.18 136.76 19.06 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.884 -0.413 . . . . 5.1600000000000001 109.884 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -126.86 109.67 12.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.122 0.487 . . . . 4.0800000000000001 110.19 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.07 118.78 37.56 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.497 -0.774 . . . . 2.6400000000000001 108.958 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.673 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.8 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.51 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.75 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.3200000000000001 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.673 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 1.02 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.461 HD11 ' HD2' ' A' ' 47' ' ' ARG . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 2.4900000000000002 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.51 HG23 ' CE1' ' A' ' 53' ' ' HIS . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 1.3899999999999999 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.702 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 2.3100000000000001 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 3.3700000000000001 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.96999999999999997 110.758 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.709 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 1.0900000000000001 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 2.4300000000000002 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 1.0600000000000001 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.3400000000000001 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.9199999999999999 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.60999999999999999 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.88 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.42999999999999999 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' HD11 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.7000000000000002 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 1.0700000000000001 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.485 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.52000000000000002 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 1.04 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.98999999999999999 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64000000000000001 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.485 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.54 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.866 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 1.05 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 2.4500000000000002 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.3200000000000001 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.63 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.94999999999999996 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.5900000000000001 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.866 ' HG3' HG23 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.71999999999999997 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.6200000000000001 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.794 ' HA ' HD11 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 1.0800000000000001 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.459 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 2.2799999999999998 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 2.0600000000000001 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 2.3900000000000001 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.524 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.9900000000000002 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.55 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.5999999999999996 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 1.4199999999999999 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.6099999999999999 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.687 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.46000000000000002 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.97 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 1.1100000000000001 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.412 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.3300000000000001 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79000000000000004 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.39000000000000001 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 2.0600000000000001 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.566 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.3400000000000001 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.64000000000000001 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 2.1200000000000001 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 1.0 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.576 ' HG3' HD22 ' A' ' 65' ' ' ASN . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.74 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.434 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 1.25 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.16 -58.08 10.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 2.1299999999999999 109.563 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.2 t -77.12 -35.83 55.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.683 -1.144 . . . . 2.2400000000000002 112.0 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -132.02 109.3 9.93 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 120.881 0.372 . . . . 6.8300000000000001 110.14 -168.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.78 68.31 0.27 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.193 0.52 . . . . 3.75 110.966 174.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.576 HD22 ' HG3' ' A' ' 59' ' ' LYS . 8.4 p30 -88.23 3.99 47.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.81 -0.632 . . . . 4.5 111.819 -175.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.587 -1.118 . . . . 6.8799999999999999 111.598 -177.535 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.479 0.18 . . . . 5.6500000000000004 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -52.48 -47.17 66.7 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.802 0.667 . . . . 5.1600000000000001 112.802 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -136.13 131.8 35.22 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.048 -0.408 . . . . 4.0800000000000001 110.925 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -104.99 139.39 39.76 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.115 -0.698 . . . . 2.6400000000000001 109.115 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.8 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.568 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.51 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.568 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.75 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.3200000000000001 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 1.02 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 2.4900000000000002 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.593 HG22 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 1.3899999999999999 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.556 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 2.3100000000000001 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 3.3700000000000001 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.96999999999999997 110.649 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 1.0900000000000001 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 2.4300000000000002 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 1.0600000000000001 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.3400000000000001 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.9199999999999999 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.60999999999999999 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.88 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.42999999999999999 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HD11 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.7000000000000002 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 1.0700000000000001 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.485 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.52000000000000002 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.551 HD11 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 1.04 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.564 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.98999999999999999 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64000000000000001 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.649 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.54 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.807 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 1.05 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 2.4500000000000002 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.3200000000000001 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.63 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.551 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.94999999999999996 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.5900000000000001 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.71999999999999997 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.57 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.6200000000000001 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 1.0800000000000001 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 2.2799999999999998 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.661 HG22 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 2.0600000000000001 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 2.3900000000000001 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.9900000000000002 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.55 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.661 ' HA ' HG22 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.5999999999999996 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.4199999999999999 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.6099999999999999 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.808 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.46000000000000002 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.633 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.97 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 1.1100000000000001 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.633 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.3300000000000001 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.474 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79000000000000004 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.922 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.39000000000000001 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 2.0600000000000001 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.3400000000000001 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.922 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.64000000000000001 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 2.1200000000000001 110.573 172.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.496 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 1.0 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.649 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.74 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.652 HD21 ' H ' ' A' ' 65' ' ' ASN . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 1.25 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp -82.66 -38.89 22.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 2.1299999999999999 110.912 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -90.17 -51.86 5.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.093 -0.503 . . . . 2.2400000000000002 111.93 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.1 mtm180 -90.62 -38.0 13.41 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.333 -0.23 . . . . 6.8300000000000001 110.983 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 68.38 116.03 0.04 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 O-C-N 124.101 0.876 . . . . 3.75 111.267 -176.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.652 ' H ' HD21 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -110.3 152.12 26.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.047 -0.723 . . . . 4.5 109.047 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.531 -1.149 . . . . 6.8799999999999999 111.95 179.534 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.647 0.26 . . . . 5.6500000000000004 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -91.27 135.35 33.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.689 0.281 . . . . 5.1600000000000001 110.626 -177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -103.98 111.83 24.56 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.406 -0.59 . . . . 4.0800000000000001 109.406 177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -103.54 147.6 26.98 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.927 -0.579 . . . . 2.6400000000000001 110.544 -174.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.643 HD23 HG11 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.8 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.593 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.51 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.593 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.75 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.3200000000000001 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.497 ' HB3' HD22 ' A' ' 5' ' ' LEU . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 1.02 108.584 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 2.4900000000000002 111.699 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.643 HG11 HD23 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 1.3899999999999999 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 2.3100000000000001 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 3.3700000000000001 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.96999999999999997 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.79 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 1.0900000000000001 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 2.4300000000000002 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 1.0600000000000001 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.478 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.3400000000000001 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.9199999999999999 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.60999999999999999 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.473 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.88 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.42999999999999999 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.7000000000000002 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 1.0700000000000001 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.5 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.52000000000000002 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 1.04 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.495 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.98999999999999999 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64000000000000001 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.54 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 1.05 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.681 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 2.4500000000000002 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.422 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.3200000000000001 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.63 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.94999999999999996 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.5900000000000001 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.821 ' HG3' HG23 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.71999999999999997 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.563 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.6200000000000001 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.832 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 1.0800000000000001 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.49 ' O ' ' HB1' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 2.2799999999999998 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 2.0600000000000001 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 2.3900000000000001 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.9900000000000002 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.55 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.5999999999999996 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 1.4199999999999999 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.6099999999999999 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.753 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.46000000000000002 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.832 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.97 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 1.1100000000000001 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.3300000000000001 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.461 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79000000000000004 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.891 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.39000000000000001 109.29 176.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 2.0600000000000001 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.6 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.3400000000000001 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.891 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.64000000000000001 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 2.1200000000000001 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.6 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 1.0 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 63' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.74 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 1.25 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp -60.24 -41.38 93.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 2.1299999999999999 110.959 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.6 p -75.41 -12.99 60.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 2.2400000000000002 111.142 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 23.3 mtp-105 -105.01 26.08 9.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 6.8300000000000001 111.105 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 58.38 46.96 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 3.75 111.572 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -143.23 164.22 30.79 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.188 -0.671 . . . . 4.5 109.188 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.267 -1.296 . . . . 6.8799999999999999 111.23 176.317 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.105 0.478 . . . . 5.6500000000000004 110.489 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -69.66 125.06 25.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 5.1600000000000001 111.123 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -158.57 119.05 3.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.818 -0.628 . . . . 4.0800000000000001 109.918 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -102.07 162.26 13.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.324 -0.621 . . . . 2.6400000000000001 109.324 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.582 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.8 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.555 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.51 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.563 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.75 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.3200000000000001 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.582 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 1.02 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 2.4900000000000002 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.494 HG22 ' CE1' ' A' ' 53' ' ' HIS . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 1.3899999999999999 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 2.3100000000000001 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 3.3700000000000001 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.96999999999999997 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.799 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 1.0900000000000001 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 2.4300000000000002 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 1.0600000000000001 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.3400000000000001 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.9199999999999999 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.60999999999999999 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.88 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.42999999999999999 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HA ' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.7000000000000002 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 1.0700000000000001 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.563 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.52000000000000002 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 1.04 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.445 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.98999999999999999 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64000000000000001 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.563 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.54 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.719 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 1.05 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.66 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 2.4500000000000002 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.3200000000000001 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.63 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.94999999999999996 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.5900000000000001 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.719 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.71999999999999997 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.582 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.6200000000000001 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB3' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 1.0800000000000001 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.568 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 2.2799999999999998 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 2.0600000000000001 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 2.3900000000000001 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.505 ' C ' ' H ' ' A' ' 45' ' ' ARG . 88.7 m-70 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.9900000000000002 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.55 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.505 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.5999999999999996 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 1.4199999999999999 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.6099999999999999 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.843 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.46000000000000002 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.97 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.563 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 1.1100000000000001 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.582 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.3300000000000001 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.496 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79000000000000004 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.834 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.39000000000000001 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 2.0600000000000001 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.3400000000000001 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.64000000000000001 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 2.1200000000000001 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.588 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.499 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.74 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.475 HD21 HD21 ' A' ' 65' ' ' ASN . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 1.25 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.96 -43.94 97.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 2.1299999999999999 110.337 177.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.2 m -65.25 -36.61 84.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 2.2400000000000002 110.806 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -85.46 12.06 9.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.858 0.361 . . . . 6.8300000000000001 111.422 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 54.97 41.08 32.19 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.744 -0.662 . . . . 3.75 111.727 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.475 HD21 HD21 ' A' ' 60' ' ' LEU . 64.8 t30 -113.55 14.08 18.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.568 0.699 . . . . 4.5 109.681 178.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.757 -1.024 . . . . 6.8799999999999999 111.339 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 tpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.633 -0.506 . . . . 5.6500000000000004 109.633 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -104.71 113.77 27.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.759 -0.83 . . . . 5.1600000000000001 108.759 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -136.08 119.35 16.7 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.037 0.446 . . . . 4.0800000000000001 111.478 -173.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -103.79 143.62 32.57 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.009 -0.738 . . . . 2.6400000000000001 109.009 171.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.859 HD13 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.8 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.601 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 3.4 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.51 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.75 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.3200000000000001 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.859 ' HB3' HD13 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 1.02 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.612 HD12 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 2.4900000000000002 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.826 HG11 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 1.3899999999999999 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.618 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 2.3100000000000001 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.588 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 3.3700000000000001 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.96999999999999997 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 1.0900000000000001 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 2.4300000000000002 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 1.0600000000000001 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.3400000000000001 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.9199999999999999 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.60999999999999999 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.88 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.42999999999999999 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.7000000000000002 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 1.0700000000000001 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.523 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.52000000000000002 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.482 HG22 HG23 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 1.04 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.416 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.98999999999999999 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64000000000000001 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.615 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.54 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.581 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 1.05 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 2.4500000000000002 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.601 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.3200000000000001 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.63 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.94999999999999996 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.5900000000000001 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.53 ' HD3' HG23 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.71999999999999997 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.629 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.6200000000000001 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 1.0800000000000001 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.584 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 2.2799999999999998 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 2.0600000000000001 110.135 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 2.3900000000000001 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.424 ' C ' ' H ' ' A' ' 45' ' ' ARG . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.9900000000000002 111.525 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.55 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.424 ' H ' ' C ' ' A' ' 43' ' ' HIS . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.5999999999999996 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 45' ' ' ARG . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 1.4199999999999999 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.612 ' HD3' HD12 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.6099999999999999 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.657 ' HA ' ' HB2' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.46000000000000002 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.97 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.423 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 1.1100000000000001 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.3300000000000001 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79000000000000004 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.892 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.39000000000000001 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 2.0600000000000001 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.3400000000000001 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.892 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.64000000000000001 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 2.1200000000000001 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.654 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 1.0 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.74 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.558 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 1.25 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.18 -35.51 80.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 2.1299999999999999 110.29 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.9 t -60.83 -28.53 68.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 2.2400000000000002 110.487 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -102.45 20.39 17.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.02 -0.536 . . . . 6.8300000000000001 110.705 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 57.6 39.63 27.44 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.795 -0.639 . . . . 3.75 112.461 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 7.6 t30 -90.29 -58.42 2.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.185 0.517 . . . . 4.5 109.972 175.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.0 -1.444 . . . . 6.8799999999999999 111.197 -177.167 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 121.358 0.599 . . . . 2.64 111.058 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.18 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.556 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.22 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.556 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.68 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.32 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 0.72 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.849 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 1.9 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.979 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 0.56 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 1.79 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 2.88 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.427 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.71 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.748 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.3 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 1.81 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 0.69 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.34 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.538 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.21 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.49 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.71 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.36 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.642 ' HA ' HD12 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.23 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 0.49 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.665 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.44 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 0.2 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.57 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.665 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.06 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.926 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 0.27 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.93 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 1.86 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.11 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.56 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.95 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.93 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.44 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.01 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 0.37 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 1.77 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 1.47 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 1.96 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.26 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.44 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.463 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.04 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 0.74 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.15 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.979 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.4 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.33 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 0.65 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.03 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.571 ' HB3' HG23 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.28 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 1.33 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.583 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.34 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.817 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.51 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 1.57 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.583 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 0.92 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.27 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.57 HD12 ' HE1' ' A' ' 56' ' ' PHE . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 0.81 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 1.5 110.587 179.84 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.274 -0.639 . . . . 2.64 109.274 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.609 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.18 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.57 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.22 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.677 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.68 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.32 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 0.72 109.016 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 1.9 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.613 HG21 ' CE1' ' A' ' 53' ' ' HIS . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 0.56 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 13' ' ' LEU . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 1.79 111.155 178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 2.88 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.71 110.642 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.597 HG12 ' NE2' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 0.3 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 1.81 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 0.69 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.34 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.912 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.21 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.49 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.912 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.71 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.36 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.23 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 0.49 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.44 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.635 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 0.2 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.57 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.06 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.579 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 0.27 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 1.86 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.11 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.56 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.95 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.498 ' HD3' HG22 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.44 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.52 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.01 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 0.37 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 1.77 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 1.47 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 1.96 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.26 111.363 -175.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.44 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.04 109.225 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 0.74 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HD3' HD13 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.15 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.718 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.4 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.33 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.677 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.65 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.598 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.03 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.96 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.28 109.371 175.807 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 1.33 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.645 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.34 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.96 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.51 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 1.57 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.645 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 0.92 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.27 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.471 HD21 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 0.81 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 1.5 110.785 179.108 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.297 0.57 . . . . 2.64 111.672 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.18 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.558 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.22 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.558 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.68 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.32 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.646 ' HB3' HD12 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 0.72 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.583 HD22 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 1.9 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.569 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 0.56 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 1.79 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 2.88 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.71 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 0.3 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 1.81 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 0.69 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.34 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.478 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.21 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.49 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.71 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.36 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' HD12 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.23 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 0.49 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.44 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.614 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 0.2 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 1.009 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.57 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.06 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.677 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 0.27 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 1.86 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.11 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.56 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.637 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.95 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.0 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.44 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.609 ' HB2' HD12 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.01 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.549 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 0.37 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.722 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 1.77 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.662 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 1.47 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 1.96 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.26 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.44 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 1.009 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.04 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 0.74 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.583 HH11 HD22 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.15 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.677 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.4 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.722 HD11 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.33 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.65 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.03 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.458 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.979 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.28 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 1.33 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.637 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.979 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.51 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 1.57 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 0.92 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.27 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 0.81 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 1.5 110.813 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.113 0.482 . . . . 2.64 109.996 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.651 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.18 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.597 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.22 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.68 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.32 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 0.72 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.811 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 1.9 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.651 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 0.56 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.659 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 1.79 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 2.88 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.51 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.71 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 0.3 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 1.81 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 0.69 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.34 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.634 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.21 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.49 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.71 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.36 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.23 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 0.49 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.44 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CG2' HG21 ' A' ' 16' ' ' ILE . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.2 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.57 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HD3' HD21 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.06 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.586 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 0.27 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 1.86 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.11 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.56 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.95 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.0 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.44 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.578 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.01 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.787 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 0.37 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 1.77 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 1.47 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 1.96 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.401 ' C ' ' H ' ' A' ' 45' ' ' ARG . 2.9 m-70 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.26 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.44 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.04 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 0.74 110.828 176.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.15 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.787 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.4 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.687 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.33 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.65 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.578 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.03 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.924 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.28 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 1.33 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.34 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.924 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.51 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 1.57 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 0.92 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.27 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.451 HD21 ' HD3' ' A' ' 30' ' ' ARG . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 0.81 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 1.5 109.425 175.581 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 120.775 0.321 . . . . 2.64 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.18 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.561 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.22 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.68 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.32 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 0.72 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 1.9 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.567 ' CG2' ' HB3' ' A' ' 48' ' ' TRP . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 0.56 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.566 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 1.79 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 2.88 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.71 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 12' ' ' ASP . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 0.3 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 0.69 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.34 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.701 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.21 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.49 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.701 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.71 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.36 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.23 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 0.49 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.656 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.59 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 0.2 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.57 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.656 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.06 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.48 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 0.27 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.703 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 1.86 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.11 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.56 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.95 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.703 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.44 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' O ' HD22 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.01 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 0.37 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 1.77 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 1.47 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.541 HG22 ' HB2' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 1.96 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.26 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.44 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.04 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 0.74 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.15 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.593 ' HA ' ' CB ' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.4 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.33 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 0.65 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.03 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.793 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.28 110.104 177.806 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 1.33 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.633 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.34 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.793 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.51 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 1.57 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 0.92 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.576 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.27 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.81 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 1.5 110.984 179.553 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.068 0.461 . . . . 2.64 111.229 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.683 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.18 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.648 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.22 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.648 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.68 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.32 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 0.72 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.415 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 1.9 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.683 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 0.56 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.612 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.471 HD21 ' HE3' ' A' ' 24' ' ' LYS . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 1.79 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 2.88 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.56 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.71 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 0.3 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 1.81 110.116 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.69 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.463 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.34 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.729 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.21 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.49 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.729 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.71 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.36 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.23 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 0.49 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.44 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 0.2 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.685 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.57 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.597 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.06 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.482 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 0.27 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 1.86 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.11 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.56 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.95 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.785 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.44 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HB2' HD12 ' A' ' 49' ' ' LEU . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.01 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 0.37 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 1.77 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 1.47 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 1.96 112.097 -175.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.458 ' C ' ' H ' ' A' ' 45' ' ' ARG . 45.4 p-80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.26 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.458 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.04 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 0.74 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.15 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.704 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.4 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.642 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.33 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.65 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.642 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.03 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.491 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.866 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.28 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 1.33 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.625 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.34 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.866 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.51 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HG2' ' CE2' ' A' ' 56' ' ' PHE . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 1.57 110.54 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.625 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 0.92 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.597 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 0.81 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.5 110.379 -177.429 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.365 0.603 . . . . 2.64 111.484 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.62 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.18 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.623 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 28.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.22 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.68 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.32 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 0.72 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 1.9 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 0.56 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.522 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 1.79 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 2.88 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.503 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.71 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.645 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 0.3 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 1.81 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 0.69 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.34 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.21 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.49 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.71 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.36 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.23 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 0.49 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.478 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.44 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 0.2 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.57 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.06 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.668 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 0.27 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 1.86 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.11 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.571 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.56 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.711 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.95 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.0 113.401 168.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.44 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.635 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.01 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.857 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 0.37 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.77 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 1.47 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 1.96 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.26 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.44 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.04 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 0.74 111.061 176.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.724 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.15 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.4 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.857 HD13 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.33 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 0.65 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.52 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.03 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.28 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 1.33 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.34 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.954 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.51 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 1.57 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.589 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 0.92 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.954 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.27 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 0.81 111.849 -175.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp . . . . . 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 1.5 110.512 177.982 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.066 0.46 . . . . 2.64 111.735 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.18 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.503 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.22 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.503 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.68 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.32 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 0.72 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 1.9 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.655 HG13 HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 0.56 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.571 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.731 HD11 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 1.79 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.492 ' HG3' ' OD2' ' A' ' 12' ' ' ASP . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 2.88 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.71 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.61 HG23 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 0.3 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 1.81 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 0.69 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.34 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.645 HG21 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.21 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.49 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.71 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.36 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.23 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 0.49 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.686 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.44 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.645 HG12 HG21 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 0.2 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.57 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.686 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.06 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 0.27 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.902 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 1.86 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.11 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.56 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.95 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.0 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.902 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.44 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.01 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.727 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 0.37 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.483 ' HE2' HD11 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 1.77 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 1.47 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 1.96 110.044 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.26 110.659 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.44 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.731 ' HD3' HD11 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.04 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 0.74 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.15 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.727 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.4 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.33 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 0.65 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.53 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.03 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.488 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.843 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.28 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 1.33 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.533 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.34 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.843 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.51 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 1.57 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 0.92 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.669 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.27 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.52 HD12 ' HE1' ' A' ' 56' ' ' PHE . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 0.81 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 1.5 110.844 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.668 -0.493 . . . . 2.64 109.668 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.739 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.18 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.564 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.1 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.22 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.564 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.68 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.32 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 0.72 109.026 -177.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.647 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 1.9 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.739 HG12 HD21 ' A' ' 5' ' ' LEU . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 0.56 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 1.79 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 2.88 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.71 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.69 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 0.3 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 1.81 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 0.69 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.34 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.21 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.49 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.71 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.36 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.23 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.49 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.44 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.592 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 0.2 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.57 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.06 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.478 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.27 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 1.86 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.11 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.56 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.75 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.95 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.0 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.44 113.453 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.706 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.01 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.946 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 0.37 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 1.77 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.453 HG13 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 1.47 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 1.96 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.26 110.233 -177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.44 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HA ' HG13 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.04 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 0.74 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.15 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.738 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.4 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.946 HD13 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.33 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 0.65 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.03 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79 109.978 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.28 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 1.33 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.75 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.34 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.51 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 1.57 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.701 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 0.92 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.27 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 0.81 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 1.5 110.527 -179.517 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.515 -0.397 0 CA-C-O 121.103 0.478 . . . . 2.64 110.279 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.579 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.18 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.64 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 27.1 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.22 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.68 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.32 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 0.72 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.46 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 1.9 111.609 -172.8 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 0.56 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.584 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 1.79 111.451 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 2.88 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.71 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 0.3 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 1.81 110.615 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.69 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.34 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.509 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.21 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.49 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.71 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.36 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' HD12 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.23 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 0.49 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.44 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 0.2 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.57 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.06 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.685 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 0.27 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 1.86 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.11 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.56 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.95 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.685 ' HG3' HG22 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.44 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.01 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 0.37 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 1.77 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 1.47 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 1.96 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.26 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.44 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.04 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 0.74 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.15 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.672 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.4 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.78 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.33 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 0.65 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.03 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.445 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.888 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.28 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 1.33 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.34 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.888 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.51 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.57 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.567 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 0.92 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.27 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.477 HD11 ' CD ' ' A' ' 30' ' ' ARG . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 0.81 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 1.5 110.761 -179.27 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 108.958 -0.756 . . . . 2.64 108.958 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.67 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.18 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.602 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.22 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.68 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.32 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.67 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 0.72 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 1.9 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 48' ' ' TRP . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 0.56 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.714 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 1.79 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 2.88 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.436 ' HB3' ' H ' ' A' ' 12' ' ' ASP . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.71 110.758 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.718 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 0.3 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 1.81 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 0.69 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.34 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.21 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.49 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.71 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.36 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.23 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 0.49 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.493 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.44 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.57 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.06 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.878 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 0.27 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 1.86 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.11 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.56 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.95 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.0 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.878 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.44 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.01 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.845 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 0.37 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 1.77 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 1.47 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 1.96 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.26 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.44 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.04 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 0.74 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.469 ' HD2' HD12 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.15 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.4 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.845 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.33 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 0.65 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.447 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.03 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.903 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.28 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 1.33 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.34 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.903 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.51 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 1.57 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 0.92 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.496 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.27 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.424 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.81 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 1.5 109.563 178.947 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 109.115 -0.698 . . . . 2.64 109.115 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.18 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.581 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.22 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.68 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.32 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 0.72 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 1.9 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.612 HG21 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 0.56 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 1.79 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 2.88 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CB ' ' H ' ' A' ' 12' ' ' ASP . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.71 110.649 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 0.3 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 1.81 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 0.69 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.34 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.21 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.49 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.71 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.36 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.23 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 0.49 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.44 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.631 HD12 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 0.2 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.56 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.57 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.628 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.06 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.838 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 0.27 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 1.86 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.11 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.56 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.563 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.95 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.0 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.838 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.44 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.01 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 0.37 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.534 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 1.77 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 1.47 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 1.96 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.26 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.44 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HA ' HG23 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.04 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 0.74 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.15 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.769 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.4 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.33 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 0.65 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.667 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.03 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.912 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.28 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 1.33 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.563 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.34 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.912 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.51 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 1.57 110.573 172.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 0.92 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.27 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.412 HD11 ' CD ' ' A' ' 30' ' ' ARG . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 0.81 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 1.5 110.912 179.134 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.708 0.29 . . . . 2.64 110.544 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.18 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.612 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.22 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.68 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.32 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 0.72 108.584 -178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.452 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 1.9 111.699 -173.1 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.694 HG12 HD21 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 0.56 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.519 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 1.79 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 2.88 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.489 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.71 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.603 HG12 ' NE2' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 0.3 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 1.81 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 0.69 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.34 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.431 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.21 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.49 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.71 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.36 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.23 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 0.49 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.44 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 0.2 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.503 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.57 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.06 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 0.27 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 1.86 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.433 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.11 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.56 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.566 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.95 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.0 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.879 ' HG3' HG22 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.44 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.01 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.888 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 0.37 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 1.77 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 1.47 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 1.96 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.465 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.26 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.44 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.04 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 0.74 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.15 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.74 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.4 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.888 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.33 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 0.65 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.03 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.889 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.4 OUTLIER -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.28 109.29 176.32 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 1.33 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.34 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.889 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.51 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 1.57 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 0.92 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.27 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 0.81 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 1.5 110.959 179.709 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.324 -0.621 . . . . 2.64 109.324 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.18 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.22 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.68 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.32 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.584 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 0.72 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 1.9 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HB3' ' A' ' 48' ' ' TRP . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 0.56 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.586 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 1.79 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 2.88 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.71 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.81 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 0.3 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 1.81 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 0.69 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.34 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.21 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.49 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.71 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.36 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.23 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 0.49 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.574 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.44 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.518 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 0.2 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.44 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.57 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.06 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.748 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 0.27 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.699 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 1.86 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.11 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.56 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.95 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.0 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.748 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.44 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.594 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.01 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.788 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 0.37 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.582 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 1.77 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 1.47 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 1.96 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' ARG . 39.5 m80 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.26 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.44 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.04 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 0.74 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.582 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.15 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.4 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.33 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 0.65 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.594 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.03 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.505 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.835 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.28 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 1.33 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.34 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.835 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.51 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 1.57 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 0.92 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.27 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.505 HD21 ' HD3' ' A' ' 30' ' ' ARG . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 0.81 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 1.5 110.337 177.4 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.009 -0.738 . . . . 2.64 109.009 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.853 HD12 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.18 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 14.1 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.22 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.68 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.32 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.853 ' HB3' HD12 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 0.72 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.632 HD13 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 1.9 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.838 HG13 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 0.56 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.631 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 1.79 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.599 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 2.88 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.71 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 0.3 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 1.81 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 0.69 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.34 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.21 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.49 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.451 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.71 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.36 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.23 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 0.49 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.53 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.44 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 0.2 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.428 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.57 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.63 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.06 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.645 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 0.27 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 1.86 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.594 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.11 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.56 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.95 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.485 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.0 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HD3' HG22 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.44 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.627 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.01 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.618 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 0.37 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 1.77 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 1.47 110.135 -174.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 1.96 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.26 111.525 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.44 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HG2' ' OH ' ' A' ' 28' ' ' TYR . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.04 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' HA ' ' A' ' 41' ' ' VAL . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 0.74 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HD3' HD13 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.15 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.645 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.4 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.597 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.33 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 0.65 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.03 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.879 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.28 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 1.33 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.34 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.879 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.51 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 1.57 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.659 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 0.92 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.594 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.27 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 0.81 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 1.5 110.29 177.623 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 120.822 0.344 . . . . 5.32 110.613 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 2' ' ' GLN . 9.1 mm-40 -80.72 96.36 6.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.139 0.495 . . . . 4.42 110.237 176.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -107.03 127.29 53.33 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.742 -0.663 . . . . 3.38 109.638 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -102.99 140.24 37.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 2.64 111.058 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.18 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.556 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.22 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.556 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.68 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.32 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 0.72 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.849 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 1.9 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.979 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 0.56 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 1.79 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 2.88 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.427 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.71 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.748 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.3 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 1.81 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 0.69 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.34 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.538 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.21 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.49 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.71 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.36 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.642 ' HA ' HD12 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.23 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 0.49 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.665 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.44 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 0.2 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.57 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.665 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.06 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.926 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 0.27 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.93 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 1.86 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.11 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.56 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.95 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.93 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.44 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.01 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 0.37 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 1.77 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 1.47 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 1.96 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.26 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.44 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.463 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.04 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 0.74 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.15 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.979 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.4 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.33 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 0.65 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.03 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.571 ' HB3' HG23 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.28 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 1.33 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.583 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.34 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.817 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.51 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 1.57 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.583 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 0.92 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.27 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.57 HD12 ' HE1' ' A' ' 56' ' ' PHE . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 0.81 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.86 -31.57 72.26 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 1.5 110.587 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.7 t -72.01 -42.06 66.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.586 -0.734 . . . . 1.84 110.706 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -84.86 -17.87 36.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.382 -0.372 . . . . 6.09 111.452 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 59.68 73.35 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.81 -0.632 . . . . 3.75 110.969 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -74.32 139.96 44.55 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.189 0.518 . . . . 4.5 110.658 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.525 -1.153 . . . . 6.88 111.461 -179.278 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.788 ' SD ' ' HG2' ' A' ' 2' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 109.359 -0.608 . . . . 5.32 109.359 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.788 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 19.4 pt20 172.82 -36.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.601 -0.889 . . . . 4.42 108.601 175.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -104.29 102.41 12.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.397 -0.964 . . . . 3.38 108.397 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -105.02 137.36 42.9 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.274 -0.639 . . . . 2.64 109.274 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.609 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.18 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.57 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.22 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.677 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.68 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.32 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 0.72 109.016 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 1.9 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.613 HG21 ' CE1' ' A' ' 53' ' ' HIS . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 0.56 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 13' ' ' LEU . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 1.79 111.155 178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 2.88 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.71 110.642 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.597 HG12 ' NE2' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 0.3 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 1.81 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 0.69 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.34 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.912 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.21 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.49 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.912 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.71 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.36 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.23 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 0.49 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.44 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.635 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 0.2 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.57 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.06 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.579 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 0.27 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 1.86 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.11 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.56 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.95 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.498 ' HD3' HG22 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.44 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.52 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.01 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 0.37 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 1.77 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 1.47 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 1.96 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.26 111.363 -175.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.44 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.04 109.225 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 0.74 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HD3' HD13 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.15 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.718 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.4 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.33 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.677 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.65 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.598 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.03 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.96 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.28 109.371 175.807 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 1.33 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.645 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.34 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.96 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.51 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 1.57 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.645 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 0.92 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.27 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.471 HD21 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 0.81 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp -66.78 -37.56 84.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 1.5 110.785 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.2 t -58.21 -38.27 76.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.715 -0.675 . . . . 1.84 110.896 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -94.68 -96.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.479 -0.328 . . . . 6.09 111.46 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -169.13 50.57 0.04 OUTLIER 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.631 -0.507 . . . . 3.75 109.631 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.6 43.39 12.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.137 -0.938 . . . . 4.5 109.223 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 CA-C-O 117.987 -1.452 . . . . 6.88 110.652 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.908 0.385 . . . . 5.32 110.603 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -74.78 144.33 43.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.58 -0.526 . . . . 4.42 109.58 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -104.35 134.59 47.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.244 -0.434 . . . . 3.38 110.507 -173.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -116.89 133.95 55.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.297 0.57 . . . . 2.64 111.672 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.18 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.22 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.558 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.68 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.32 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.646 ' HB3' HD12 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 0.72 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.583 HD22 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 1.9 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.569 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 0.56 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 1.79 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 2.88 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.71 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 0.3 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 1.81 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 0.69 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.34 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.478 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.21 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.49 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.71 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.36 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' HD12 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.23 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 0.49 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.44 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.614 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 0.2 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 1.009 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.57 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.06 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.677 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 0.27 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 1.86 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.11 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.56 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.637 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.95 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.0 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.44 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.609 ' HB2' HD12 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.01 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.549 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 0.37 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.722 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 1.77 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.662 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 1.47 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 1.96 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.26 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.44 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 1.009 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.04 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 0.74 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.583 HH11 HD22 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.15 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.677 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.4 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.722 HD11 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.33 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.65 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.03 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.458 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.979 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.28 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 1.33 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.637 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.979 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.51 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 1.57 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 0.92 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.27 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 0.81 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp -75.23 -47.21 29.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 1.5 110.813 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.0 m -76.85 -40.22 48.49 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.082 -0.508 . . . . 1.84 111.213 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -117.99 78.81 1.28 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.497 -0.556 . . . . 6.09 109.497 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.88 100.01 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.694 -0.685 . . . . 3.75 111.944 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -125.86 15.15 8.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.398 0.618 . . . . 4.5 109.68 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 CA-C-O 118.817 -0.991 . . . . 6.88 110.938 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 tpp . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.718 0.294 . . . . 5.32 110.927 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -79.99 132.12 35.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.172 0.51 . . . . 4.42 111.377 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -118.81 121.36 39.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 3.38 110.025 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -103.56 105.34 15.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.113 0.482 . . . . 2.64 109.996 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.651 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.18 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.597 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.22 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.68 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.32 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 0.72 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.811 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 1.9 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.651 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 0.56 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.659 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 1.79 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 2.88 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.51 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.71 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 0.3 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 1.81 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 0.69 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.34 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.634 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.21 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.49 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.71 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.36 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.23 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 0.49 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.44 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CG2' HG21 ' A' ' 16' ' ' ILE . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.2 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.57 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HD3' HD21 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.06 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.586 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 0.27 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 1.86 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.11 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.56 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.95 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.0 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.44 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.578 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.01 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.787 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 0.37 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 1.77 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 1.47 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 1.96 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.401 ' C ' ' H ' ' A' ' 45' ' ' ARG . 2.9 m-70 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.26 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.44 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.04 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 0.74 110.828 176.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.15 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.787 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.4 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.687 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.33 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.65 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.578 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.03 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.924 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.28 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 1.33 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.34 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.924 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.51 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 1.57 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 0.92 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.27 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.451 HD21 ' HD3' ' A' ' 30' ' ' ARG . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 0.81 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.5 -32.8 70.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 1.5 109.425 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -84.71 -9.01 58.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.236 -0.893 . . . . 1.84 110.495 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 44.57 40.92 4.35 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.808 -1.087 . . . . 6.09 112.796 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 60.58 1.38 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.149 0.5 . . . . 3.75 110.661 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -149.41 27.78 0.82 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 4.5 110.395 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.797 -1.002 . . . . 6.88 111.437 -179.669 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 5.32 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -139.31 143.95 38.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.456 -0.338 . . . . 4.42 110.759 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -104.16 104.63 14.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.147 -0.479 . . . . 3.38 110.055 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -104.49 145.06 30.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.775 0.321 . . . . 2.64 110.141 174.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.18 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.561 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.22 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.68 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.32 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 0.72 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 1.9 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.567 ' CG2' ' HB3' ' A' ' 48' ' ' TRP . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 0.56 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.566 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 1.79 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 2.88 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.71 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 12' ' ' ASP . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 0.3 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 0.69 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.34 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.701 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.21 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.49 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.701 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.71 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.36 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.23 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 0.49 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.656 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.59 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 0.2 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.57 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.656 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.06 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.48 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 0.27 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.703 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 1.86 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.11 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.56 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.95 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.703 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.44 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' O ' HD22 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.01 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 0.37 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 1.77 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 1.47 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.541 HG22 ' HB2' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 1.96 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.26 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.44 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.04 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 0.74 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.15 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.593 ' HA ' ' CB ' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.4 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.33 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 0.65 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.03 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.793 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.28 110.104 177.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 1.33 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.633 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.34 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.793 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.51 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 1.57 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 0.92 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.576 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.27 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.81 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp -72.02 -42.12 66.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 1.5 110.984 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.2 t -74.15 -51.38 15.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 1.84 111.802 -177.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -100.9 -16.15 17.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.226 0.454 . . . . 6.09 112.226 -171.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 52.46 79.79 0.11 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.022 0.439 . . . . 3.75 111.882 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -126.18 172.78 9.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 4.5 110.425 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.192 0 CA-C-O 118.658 -1.079 . . . . 6.88 111.921 -179.606 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mmm . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.709 0.29 . . . . 5.32 110.616 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 44.7 tp60 -166.56 108.63 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.802 0.334 . . . . 4.42 110.378 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -108.76 120.47 42.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.227 -0.657 . . . . 3.38 109.227 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -103.23 134.76 46.1 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.068 0.461 . . . . 2.64 111.229 -175.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.683 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.18 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.648 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.22 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.648 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.68 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.32 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 0.72 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.415 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 1.9 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.683 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 0.56 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.612 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.471 HD21 ' HE3' ' A' ' 24' ' ' LYS . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 1.79 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 2.88 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.56 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.71 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 0.3 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 1.81 110.116 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.69 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.463 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.34 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.729 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.21 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.49 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.729 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.71 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.36 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.23 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 0.49 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.44 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 0.2 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.685 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.57 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.597 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.06 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.482 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 0.27 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 1.86 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.11 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.56 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.95 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.785 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.44 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HB2' HD12 ' A' ' 49' ' ' LEU . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.01 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 0.37 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 1.77 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 1.47 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 1.96 112.097 -175.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.458 ' C ' ' H ' ' A' ' 45' ' ' ARG . 45.4 p-80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.26 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.458 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.04 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 0.74 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.15 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.704 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.4 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.642 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.33 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.65 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.642 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.03 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.491 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.866 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.28 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 1.33 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.625 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.34 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.866 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.51 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HG2' ' CE2' ' A' ' 56' ' ' PHE . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 1.57 110.54 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.625 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 0.92 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.597 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 0.81 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.8 -58.75 7.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.5 110.379 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.8 p -81.93 -32.6 30.78 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.149 -0.932 . . . . 1.84 111.3 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -126.15 88.19 2.8 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.771 -0.65 . . . . 6.09 111.221 -172.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 92.46 0.13 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.727 -0.669 . . . . 3.75 110.471 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -50.91 46.95 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.081 -0.508 . . . . 4.5 111.344 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.661 -1.077 . . . . 6.88 111.156 -173.933 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.32 110.759 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 4.42 108.994 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 3.38 110.086 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 174.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 1.84 111.1 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.09 111.632 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.88 111.816 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.32 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 4.42 108.994 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 3.38 110.086 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 1.84 111.1 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.09 111.632 -175.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.88 111.816 177.443 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.231 0.539 . . . . 5.32 110.032 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -106.88 144.58 33.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.948 -0.569 . . . . 4.42 110.427 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -103.34 114.02 27.96 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.741 -0.837 . . . . 3.38 108.741 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -103.31 135.81 44.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.365 0.603 . . . . 2.64 111.484 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.62 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.18 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.623 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 28.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.22 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.68 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.32 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 0.72 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 1.9 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 0.56 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.522 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 1.79 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 2.88 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.503 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.71 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.645 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 0.3 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 1.81 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 0.69 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.34 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.21 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.49 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.71 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.36 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.23 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 0.49 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.478 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.44 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 0.2 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.57 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.06 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.668 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 0.27 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 1.86 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.11 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.571 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.56 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.711 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.95 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.0 113.401 168.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.44 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.635 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.01 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.857 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 0.37 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.77 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 1.47 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 1.96 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.26 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.44 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.04 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 0.74 111.061 176.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.724 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.15 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.4 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.857 HD13 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.33 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 0.65 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.52 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.03 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.28 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 1.33 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.34 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.954 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.51 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 1.57 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.589 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 0.92 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.954 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.27 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 65' ' ' ASN . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 0.81 111.849 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp -79.12 -37.07 39.52 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 1.5 110.512 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.0 p -86.4 -51.4 6.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.888 -0.596 . . . . 1.84 111.856 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -108.25 -5.66 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.361 0.504 . . . . 6.09 112.361 -173.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 47.94 73.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.138 0.494 . . . . 3.75 112.275 175.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.521 ' H ' HD23 ' A' ' 60' ' ' LEU . 31.3 m-80 -91.54 -165.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 4.5 110.111 -177.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.42 -1.211 . . . . 6.88 112.316 176.088 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 tpp . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 109.565 -0.531 . . . . 5.32 109.565 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -76.15 53.18 0.78 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.871 0.693 . . . . 4.42 112.871 -172.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -144.14 133.52 23.25 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.508 -0.923 . . . . 3.38 108.508 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.58 157.77 22.59 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.066 0.46 . . . . 2.64 111.735 -167.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.18 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.503 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.22 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.503 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.68 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.32 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 0.72 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 1.9 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.655 HG13 HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 0.56 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.571 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.731 HD11 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 1.79 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.492 ' HG3' ' OD2' ' A' ' 12' ' ' ASP . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 2.88 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.71 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.61 HG23 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 0.3 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 1.81 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 0.69 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.34 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.645 HG21 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.21 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.49 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HE1' HD21 ' A' ' 65' ' ' ASN . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.71 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.36 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.23 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 0.49 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.686 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.44 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.645 HG12 HG21 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 0.2 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.57 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.686 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.06 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 0.27 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.902 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 1.86 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.11 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.56 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.95 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.0 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.902 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.44 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.01 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.727 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 0.37 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.483 ' HE2' HD11 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 1.77 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 1.47 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 1.96 110.044 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.26 110.659 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.44 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.731 ' HD3' HD11 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.04 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 0.74 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.15 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.727 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.4 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.33 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 0.65 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.53 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.03 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.488 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.843 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.28 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 1.33 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.533 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.34 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.843 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.51 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 1.57 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 0.92 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.669 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.27 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.948 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 0.81 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp -63.12 -41.75 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 1.5 110.844 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.2 p -74.51 -9.36 58.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.869 -0.605 . . . . 1.84 111.022 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -98.26 -81.49 0.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.416 -0.357 . . . . 6.09 110.702 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -171.22 29.89 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.534 -0.303 . . . . 3.75 111.636 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.948 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 48.3 t-20 -140.15 94.43 2.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 4.5 110.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.022 -1.432 . . . . 6.88 111.278 177.488 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.172 0.51 . . . . 5.32 109.83 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -97.22 -16.16 20.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.868 -0.606 . . . . 4.42 110.6 -173.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -119.7 131.28 55.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 3.38 110.859 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.59 166.26 10.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.668 -0.493 . . . . 2.64 109.668 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.739 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.18 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.564 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.1 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.22 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.564 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.68 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.32 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 0.72 109.026 -177.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.647 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 1.9 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.739 HG12 HD21 ' A' ' 5' ' ' LEU . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 0.56 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 1.79 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 2.88 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.71 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.69 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 0.3 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 1.81 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 0.69 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.34 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.21 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.49 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.71 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.36 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.23 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.49 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.44 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.592 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 0.2 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.57 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.06 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.478 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.27 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 1.86 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.11 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.56 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.75 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.95 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.0 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.44 113.453 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.706 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.01 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.946 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 0.37 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 1.77 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.453 HG13 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 1.47 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 1.96 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.26 110.233 -177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.44 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HA ' HG13 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.04 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 0.74 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.15 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.738 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.4 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.946 HD13 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.33 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 0.65 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.03 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79 109.978 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.28 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 1.33 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.75 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.34 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.51 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 1.57 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.701 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 0.92 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.27 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 0.81 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp -65.4 -36.01 82.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 1.5 110.527 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -78.5 -7.35 57.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.749 -0.659 . . . . 1.84 110.822 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 51.91 37.51 21.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.013 -0.994 . . . . 6.09 112.069 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -98.87 36.0 1.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.484 0.659 . . . . 3.75 109.828 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.8 72.15 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.416 -0.811 . . . . 4.5 110.398 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.76 -1.022 . . . . 6.88 111.833 179.183 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 tmm? . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.028 -0.36 . . . . 5.32 110.028 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.05 137.67 58.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.488 . . . . 4.42 111.303 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -104.17 104.73 14.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.051 -1.092 . . . . 3.38 108.051 174.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -101.08 103.66 14.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.103 0.478 . . . . 2.64 110.279 -171.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.579 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.18 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.64 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 27.1 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.22 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.68 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.32 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 0.72 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.46 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 1.9 111.609 -172.8 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 0.56 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.584 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 1.79 111.451 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 2.88 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.71 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 0.3 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 1.81 110.615 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.69 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.34 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.509 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.21 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.49 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.71 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.36 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' HD12 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.23 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 0.49 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.44 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 0.2 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.57 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.06 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.685 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 0.27 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 1.86 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.11 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.56 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.95 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.685 ' HG3' HG22 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.44 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.01 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 0.37 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 1.77 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 1.47 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 1.96 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.26 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.44 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.04 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 0.74 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.15 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.672 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.4 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.78 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.33 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 0.65 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.03 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.445 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.888 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.28 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 1.33 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.34 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.888 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.51 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.57 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.567 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 0.92 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.27 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.501 ' O ' ' HA ' ' A' ' 64' ' ' ALA . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 0.81 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp -82.91 -46.35 13.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 1.5 110.761 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t -74.33 -50.11 20.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 1.84 110.575 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.6 mtt180 -80.49 -21.5 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.344 -0.389 . . . . 6.09 111.086 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 46.72 65.53 1.19 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.527 0.517 . . . . 3.75 111.801 175.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -112.0 72.89 0.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.71 0.767 . . . . 4.5 110.856 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-N 115.355 -0.839 . . . . 6.88 111.118 179.22 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.778 0.323 . . . . 5.32 110.527 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -150.18 136.76 19.06 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.884 -0.413 . . . . 4.42 109.884 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -126.86 109.67 12.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.122 0.487 . . . . 3.38 110.19 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.07 118.78 37.56 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.497 -0.774 . . . . 2.64 108.958 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.67 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.18 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.602 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.22 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.68 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.32 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.67 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 0.72 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 1.9 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 48' ' ' TRP . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 0.56 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.714 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 1.79 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 2.88 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.436 ' HB3' ' H ' ' A' ' 12' ' ' ASP . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.71 110.758 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.718 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 0.3 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 1.81 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 0.69 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.34 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.21 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.49 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.71 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.36 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.23 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 0.49 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.493 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.44 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.57 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.06 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.878 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 0.27 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 1.86 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.11 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.56 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.95 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.0 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.878 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.44 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.01 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.845 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 0.37 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 1.77 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 1.47 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 1.96 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.26 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.44 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.04 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 0.74 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.469 ' HD2' HD12 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.15 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.4 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.845 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.33 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 0.65 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.447 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.03 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.903 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.28 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 1.33 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.34 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.903 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.51 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 1.57 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 0.92 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HG3' HD21 ' A' ' 65' ' ' ASN . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.27 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.424 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.81 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.16 -58.08 10.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 1.5 109.563 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.2 t -77.12 -35.83 55.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.683 -1.144 . . . . 1.84 112.0 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -132.02 109.3 9.93 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 120.881 0.372 . . . . 6.09 110.14 -168.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.78 68.31 0.27 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.193 0.52 . . . . 3.75 110.966 174.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.638 HD21 ' HG3' ' A' ' 59' ' ' LYS . 8.4 p30 -88.23 3.99 47.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.81 -0.632 . . . . 4.5 111.819 -175.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.587 -1.118 . . . . 6.88 111.598 -177.535 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.479 0.18 . . . . 5.32 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -52.48 -47.17 66.7 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.802 0.667 . . . . 4.42 112.802 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -136.13 131.8 35.22 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.048 -0.408 . . . . 3.38 110.925 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -104.99 139.39 39.76 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.115 -0.698 . . . . 2.64 109.115 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.18 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.581 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.22 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.68 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.32 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 0.72 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 1.9 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.612 HG21 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 0.56 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 1.79 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 2.88 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CB ' ' H ' ' A' ' 12' ' ' ASP . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.71 110.649 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 0.3 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 1.81 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 0.69 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.34 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.21 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.49 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.71 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.36 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.23 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 0.49 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.44 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.631 HD12 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 0.2 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.56 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.57 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.628 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.06 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.838 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 0.27 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 1.86 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.11 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.56 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.563 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.95 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.0 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.838 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.44 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.01 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 0.37 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.534 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 1.77 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 1.47 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 1.96 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.26 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.44 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HA ' HG23 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.04 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 0.74 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.15 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.769 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.4 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.33 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 0.65 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.667 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.03 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.912 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.28 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 1.33 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.563 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.34 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.912 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.51 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 1.57 110.573 172.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 0.92 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.27 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.729 HD23 ' H ' ' A' ' 65' ' ' ASN . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 0.81 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp -82.66 -38.89 22.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 1.5 110.912 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -90.17 -51.86 5.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.093 -0.503 . . . . 1.84 111.93 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.1 mtm180 -90.62 -38.0 13.41 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.333 -0.23 . . . . 6.09 110.983 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 68.38 116.03 0.04 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 O-C-N 124.101 0.876 . . . . 3.75 111.267 -176.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.729 ' H ' HD23 ' A' ' 60' ' ' LEU . 2.1 m-20 -110.3 152.12 26.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.047 -0.723 . . . . 4.5 109.047 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.531 -1.149 . . . . 6.88 111.95 179.534 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.647 0.26 . . . . 5.32 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -91.27 135.35 33.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.689 0.281 . . . . 4.42 110.626 -177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -103.98 111.83 24.56 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.406 -0.59 . . . . 3.38 109.406 177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -103.54 147.6 26.98 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.927 -0.579 . . . . 2.64 110.544 -174.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.18 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.612 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.22 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.68 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.32 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 0.72 108.584 -178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.452 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 1.9 111.699 -173.1 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.694 HG12 HD21 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 0.56 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.519 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 1.79 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 2.88 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.489 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.71 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.603 HG12 ' NE2' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 0.3 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 1.81 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 0.69 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.34 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.431 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.21 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.49 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.71 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.36 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.23 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 0.49 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.44 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 0.2 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.503 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.57 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.06 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 0.27 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 1.86 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.433 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.11 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.56 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.566 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.95 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.0 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.879 ' HG3' HG22 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.44 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.01 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.888 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 0.37 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 1.77 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 1.47 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 1.96 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.465 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.26 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.44 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.04 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 0.74 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.15 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.74 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.4 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.888 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.33 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 0.65 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.03 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.889 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 0.4 OUTLIER -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.28 109.29 176.32 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 1.33 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.34 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.889 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.51 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 1.57 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 0.92 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.27 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 0.81 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp -60.24 -41.38 93.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 1.5 110.959 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.6 p -75.41 -12.99 60.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 1.84 111.142 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 23.3 mtp-105 -105.01 26.08 9.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 6.09 111.105 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 58.38 46.96 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 3.75 111.572 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -143.23 164.22 30.79 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.188 -0.671 . . . . 4.5 109.188 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.267 -1.296 . . . . 6.88 111.23 176.317 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.105 0.478 . . . . 5.32 110.489 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -69.66 125.06 25.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 4.42 111.123 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -158.57 119.05 3.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.818 -0.628 . . . . 3.38 109.918 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -102.07 162.26 13.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.324 -0.621 . . . . 2.64 109.324 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.18 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.22 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.68 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.32 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.584 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 0.72 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 1.9 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HB3' ' A' ' 48' ' ' TRP . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 0.56 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.586 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 1.79 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 2.88 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.71 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.81 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 0.3 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 1.81 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 0.69 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.34 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.21 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.49 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.71 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.36 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.23 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 0.49 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.574 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.44 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.518 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 0.2 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.44 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.57 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.06 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.748 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 0.27 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.699 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 1.86 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.11 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.56 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.95 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.0 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.748 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.44 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.594 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.01 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.788 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 0.37 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.582 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 1.77 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 1.47 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 1.96 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' ARG . 39.5 m80 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.26 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.44 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.04 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 0.74 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.582 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.15 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.4 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.33 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 0.65 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.594 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.03 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.505 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.835 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.28 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 1.33 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.34 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.835 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.51 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 1.57 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 0.92 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.27 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.505 HD21 ' HD3' ' A' ' 30' ' ' ARG . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 0.81 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.96 -43.94 97.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 1.5 110.337 177.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.2 m -65.25 -36.61 84.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 1.84 110.806 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -85.46 12.06 9.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.858 0.361 . . . . 6.09 111.422 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 54.97 41.08 32.19 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.744 -0.662 . . . . 3.75 111.727 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.55 14.08 18.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.568 0.699 . . . . 4.5 109.681 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.757 -1.024 . . . . 6.88 111.339 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 tpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.633 -0.506 . . . . 5.32 109.633 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -104.71 113.77 27.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.759 -0.83 . . . . 4.42 108.759 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -136.08 119.35 16.7 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.037 0.446 . . . . 3.38 111.478 -173.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -103.79 143.62 32.57 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.009 -0.738 . . . . 2.64 109.009 171.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.853 HD12 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.18 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 14.1 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.22 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.68 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.32 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.853 ' HB3' HD12 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 0.72 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.632 HD13 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 1.9 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.838 HG13 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 0.56 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.631 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 1.79 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.599 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 2.88 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.71 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 0.3 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 1.81 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 0.69 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.34 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.21 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.49 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.451 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.71 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.36 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.23 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 0.49 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.53 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.44 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 0.2 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.428 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.57 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.63 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.06 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.645 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 0.27 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 1.86 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.594 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.11 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.56 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.95 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.485 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.0 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HD3' HG22 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.44 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.627 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.01 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.618 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 0.37 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 1.77 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 1.47 110.135 -174.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 1.96 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.26 111.525 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.44 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HG2' ' OH ' ' A' ' 28' ' ' TYR . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.04 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' HA ' ' A' ' 41' ' ' VAL . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 0.74 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HD3' HD13 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.15 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.645 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.4 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.597 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.33 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 0.65 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.03 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.879 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.28 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 1.33 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.34 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.879 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.51 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 1.57 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.659 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 0.92 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.594 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.27 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 0.81 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.18 -35.51 80.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 1.5 110.29 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.9 t -60.83 -28.53 68.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 1.84 110.487 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -102.45 20.39 17.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.02 -0.536 . . . . 6.09 110.705 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 57.6 39.63 27.44 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.795 -0.639 . . . . 3.75 112.461 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 7.6 t30 -90.29 -58.42 2.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.185 0.517 . . . . 4.5 109.972 175.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.0 -1.444 . . . . 6.88 111.197 -177.167 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 121.358 0.599 . . . . 2.64 111.058 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.18 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.556 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.22 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.556 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.68 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.32 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 0.72 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.849 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 1.9 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.979 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 0.56 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 1.79 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 2.88 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.427 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.71 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.748 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.3 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 1.81 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 0.69 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.34 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.538 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.21 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.49 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.71 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.36 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.642 ' HA ' HD12 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.23 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 0.49 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.665 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.44 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 0.2 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.57 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.665 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.06 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.926 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 0.27 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.93 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 1.86 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.11 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.56 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.95 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.93 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.44 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.01 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 0.37 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 1.77 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 1.47 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 1.96 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.26 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.44 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.463 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.04 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 0.74 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.15 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.979 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.4 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.33 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 0.65 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.03 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.571 ' HB3' HG23 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.28 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 1.33 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.583 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.34 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.817 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.51 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 1.57 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.583 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 0.92 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.27 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.57 HD12 ' HE1' ' A' ' 56' ' ' PHE . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 0.81 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 1.5 110.587 179.84 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.274 -0.639 . . . . 2.64 109.274 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.609 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.18 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.57 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.22 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.677 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.68 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.32 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 0.72 109.016 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 1.9 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.609 HG12 HD21 ' A' ' 5' ' ' LEU . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 0.56 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 13' ' ' LEU . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 1.79 111.155 178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 2.88 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.71 110.642 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.796 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 0.3 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 1.81 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 0.69 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.34 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.912 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.21 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.49 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.912 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.71 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.36 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.23 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 0.49 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.44 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.635 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 0.2 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.57 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.06 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.579 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 0.27 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 1.86 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.11 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.56 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.95 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.498 ' HD3' HG22 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.44 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.52 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.01 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 0.37 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 1.77 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 1.47 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 1.96 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.26 111.363 -175.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.44 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.04 109.225 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 0.74 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HD3' HD13 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.15 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.718 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.4 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.33 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.677 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.65 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.598 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.03 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.96 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.7 m170 -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.28 109.371 175.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 1.33 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.645 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.34 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.96 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.51 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 1.57 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.645 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 0.92 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.27 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.471 HD21 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 0.81 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 1.5 110.785 179.108 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.297 0.57 . . . . 2.64 111.672 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.18 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.558 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.22 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.558 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.68 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.32 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.646 ' HB3' HD12 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 0.72 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.583 HD22 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 1.9 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.569 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 0.56 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 1.79 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 2.88 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.71 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 0.3 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 1.81 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 0.69 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.34 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.478 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.21 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.49 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.71 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.36 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' HD12 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.23 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 0.49 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.44 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.614 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 0.2 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 1.009 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.57 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.06 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.677 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 0.27 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 1.86 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.11 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.56 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.637 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.95 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.0 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.44 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.609 ' HB2' HD12 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.01 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.549 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 0.37 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.722 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 1.77 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.662 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 1.47 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 1.96 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.26 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.44 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 1.009 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.04 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 0.74 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.583 HH11 HD22 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.15 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.677 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.4 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.722 HD11 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.33 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.65 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.03 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.458 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.979 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.28 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 1.33 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.637 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.979 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.51 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 1.57 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 0.92 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.27 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 0.81 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 1.5 110.813 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.113 0.482 . . . . 2.64 109.996 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.651 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.18 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.597 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.22 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.68 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.32 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 0.72 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.811 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 1.9 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.651 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 0.56 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.659 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 1.79 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 2.88 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.51 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.71 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 0.3 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 1.81 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 0.69 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.34 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.634 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.21 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.49 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.71 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.36 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.23 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 0.49 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.44 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CG2' HG21 ' A' ' 16' ' ' ILE . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.2 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.57 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HD3' HD21 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.06 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.586 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 0.27 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 1.86 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.11 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.56 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.95 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.0 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.44 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.578 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.01 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.787 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 0.37 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 1.77 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 1.47 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 1.96 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.401 ' C ' ' H ' ' A' ' 45' ' ' ARG . 57.1 m170 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.26 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.44 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.04 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 0.74 110.828 176.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.15 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.787 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.4 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.687 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.33 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.65 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.578 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.03 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.924 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.28 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 1.33 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.34 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.924 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.51 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 1.57 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 0.92 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.27 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.451 HD21 ' HD3' ' A' ' 30' ' ' ARG . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 0.81 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 1.5 109.425 175.581 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 120.775 0.321 . . . . 2.64 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.18 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.561 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.22 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.68 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.32 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 0.72 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 1.9 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.629 HG21 ' CE1' ' A' ' 53' ' ' HIS . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 0.56 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.566 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 1.79 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 2.88 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.71 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.682 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 0.3 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 0.69 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.34 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.701 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.21 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.49 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.701 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.71 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.36 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.23 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 0.49 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.656 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.59 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 0.2 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.57 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.656 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.06 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.48 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 0.27 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.703 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 1.86 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.11 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.56 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.95 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.703 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.44 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' O ' HD22 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.01 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 0.37 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 1.77 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 1.47 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.541 HG22 ' HB2' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 1.96 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.26 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.44 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.04 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 0.74 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.15 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.593 ' HA ' ' CB ' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.4 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.33 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 0.65 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.03 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.793 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 19.1 m170 -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.28 110.104 177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 1.33 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.633 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.34 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.793 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.51 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 1.57 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 0.92 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.576 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.27 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.81 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 1.5 110.984 179.553 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.068 0.461 . . . . 2.64 111.229 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.683 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.18 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.648 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.22 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.648 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.68 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.32 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 0.72 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.415 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 1.9 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.683 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 0.56 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.612 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.471 HD21 ' HE3' ' A' ' 24' ' ' LYS . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 1.79 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 2.88 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.56 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.71 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 0.3 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 1.81 110.116 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.69 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.463 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.34 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.729 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.21 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.49 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.729 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.71 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.36 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.23 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 0.49 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.44 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 0.2 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.685 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.57 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.597 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.06 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.482 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 0.27 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 1.86 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.11 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.56 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.95 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.785 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.44 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HB2' HD12 ' A' ' 49' ' ' LEU . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.01 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 0.37 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 1.77 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 1.47 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 ' HD2' ' A' ' 43' ' ' HIS . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 1.96 112.097 -175.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.676 ' HD2' HG23 ' A' ' 42' ' ' ILE . 8.6 p80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.26 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.458 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.04 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 0.74 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.15 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.704 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.4 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.642 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.33 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.65 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.642 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.03 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.491 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.866 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.28 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 1.33 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.625 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.34 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.866 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.51 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HG2' ' CE2' ' A' ' 56' ' ' PHE . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 1.57 110.54 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.625 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 0.92 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.597 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 0.81 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.5 110.379 -177.429 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 N--CA 1.447 -0.601 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.365 0.603 . . . . 2.64 111.484 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.62 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.18 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.623 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.22 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.68 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.32 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 0.72 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 1.9 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 0.56 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.522 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 1.79 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 2.88 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.503 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.71 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.645 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 0.3 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 1.81 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 0.69 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.34 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.21 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.49 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.71 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.36 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.23 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 0.49 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.478 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.44 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 0.2 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.57 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.06 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.668 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 0.27 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 1.86 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.11 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.571 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.56 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.711 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.95 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.0 113.401 168.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.44 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.635 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.01 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.857 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 0.37 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.77 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 1.47 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 1.96 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.26 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.44 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.04 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 0.74 111.061 176.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.724 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.15 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.4 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.857 HD13 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.33 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 0.65 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.52 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.03 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.28 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 1.33 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.34 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.954 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.51 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 1.57 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.589 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 0.92 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.954 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.27 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 0.81 111.849 -175.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp . . . . . 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 1.5 110.512 177.982 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.066 0.46 . . . . 2.64 111.735 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.18 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.503 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.22 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.503 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.68 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.32 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 0.72 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 1.9 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.655 HG13 HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 0.56 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.571 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.731 HD11 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 1.79 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.492 ' HG3' ' OD2' ' A' ' 12' ' ' ASP . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 2.88 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.71 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.61 HG23 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 0.3 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 1.81 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 0.69 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.34 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.645 HG21 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.21 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.49 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.71 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.36 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.23 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 0.49 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.686 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.44 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.645 HG12 HG21 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 0.2 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.57 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.686 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.06 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 0.27 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.902 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 1.86 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.11 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.56 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.95 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.0 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.902 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.44 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.01 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.727 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 0.37 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.483 ' HE2' HD11 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 1.77 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 1.47 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' A' ' 43' ' ' HIS . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 1.96 110.044 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.68 ' HD2' HG23 ' A' ' 42' ' ' ILE . 53.6 m-70 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.26 110.659 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.44 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.731 ' HD3' HD11 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.04 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 0.74 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.15 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.727 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.4 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.33 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 0.65 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.53 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.03 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.488 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.843 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.28 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 1.33 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.533 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.34 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.843 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.51 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 1.57 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 0.92 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.669 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.27 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.52 HD12 ' HE1' ' A' ' 56' ' ' PHE . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 0.81 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 1.5 110.844 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.668 -0.493 . . . . 2.64 109.668 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.739 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.18 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.564 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.0 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.22 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.564 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.68 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.32 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 0.72 109.026 -177.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.647 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 1.9 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.739 HG12 HD21 ' A' ' 5' ' ' LEU . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 0.56 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 1.79 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 2.88 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.71 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.69 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 0.3 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 1.81 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 0.69 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.34 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.21 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.49 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.71 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.36 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.23 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.49 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.44 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.592 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 0.2 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.57 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.06 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.478 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.27 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 1.86 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.11 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.56 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.75 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.95 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.0 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.44 113.453 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.706 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.01 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.946 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 0.37 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 1.77 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.453 HG13 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 1.47 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 1.96 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.26 110.233 -177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.44 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HA ' HG13 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.04 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 0.74 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.15 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.738 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.4 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.946 HD13 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.33 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 0.65 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.03 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79 109.978 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.28 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 1.33 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.75 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.34 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.51 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 1.57 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.701 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 0.92 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.27 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 0.81 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 1.5 110.527 -179.517 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.515 -0.397 0 CA-C-O 121.103 0.478 . . . . 2.64 110.279 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.579 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.18 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.64 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.4 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.22 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.68 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.32 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 0.72 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.46 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 1.9 111.609 -172.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 0.56 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.584 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 1.79 111.451 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 2.88 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.71 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 0.3 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 1.81 110.615 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.69 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.34 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.509 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.21 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.49 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.71 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.36 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' HD12 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.23 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 0.49 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.44 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 0.2 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.57 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.06 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.685 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 0.27 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 1.86 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.11 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.56 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.95 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.685 ' HG3' HG22 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.44 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.01 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 0.37 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 1.77 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 1.47 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 1.96 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.26 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.44 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.04 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 0.74 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.15 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.672 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.4 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.78 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.33 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 0.65 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.03 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.445 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.888 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.28 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 1.33 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.34 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.888 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.51 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.57 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.567 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 0.92 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.27 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.477 HD11 ' CD ' ' A' ' 30' ' ' ARG . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 0.81 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 1.5 110.761 -179.27 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 108.958 -0.756 . . . . 2.64 108.958 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.67 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.18 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.602 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.22 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.68 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.32 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.67 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 0.72 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 1.9 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 48' ' ' TRP . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 0.56 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.714 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 1.79 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 2.88 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.436 ' HB3' ' H ' ' A' ' 12' ' ' ASP . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.71 110.758 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.718 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 0.3 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 1.81 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 0.69 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.34 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.21 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.49 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.71 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.36 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.23 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 0.49 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.493 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.44 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.57 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.06 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.878 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 0.27 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 1.86 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.11 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.56 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.95 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.0 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.878 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.44 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.01 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.845 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 0.37 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 1.77 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 1.47 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 1.96 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.26 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.44 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.04 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 0.74 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.469 ' HD2' HD12 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.15 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.4 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.845 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.33 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 0.65 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.447 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.03 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.903 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.28 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 1.33 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.34 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.903 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.51 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 1.57 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 0.92 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.496 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.27 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.424 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.81 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 1.5 109.563 178.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 109.115 -0.698 . . . . 2.64 109.115 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.18 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.581 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.22 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.68 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.32 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 0.72 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 1.9 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.612 HG21 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 0.56 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 1.79 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 2.88 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CB ' ' H ' ' A' ' 12' ' ' ASP . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.71 110.649 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 0.3 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 1.81 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 0.69 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.34 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.21 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.49 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.71 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.36 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.23 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 0.49 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.44 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.631 HD12 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 0.2 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.56 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.57 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.628 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.06 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.838 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 0.27 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 1.86 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.11 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.56 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.563 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.95 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.0 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.838 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.44 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.01 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 0.37 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.534 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 1.77 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 1.47 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 1.96 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.26 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.44 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HA ' HG23 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.04 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 0.74 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.15 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.769 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.4 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.33 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 0.65 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.667 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.03 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.912 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.28 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 1.33 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.563 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.34 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.912 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.51 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 1.57 110.573 172.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 0.92 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.27 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.412 HD11 ' CD ' ' A' ' 30' ' ' ARG . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 0.81 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 1.5 110.912 179.134 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.708 0.29 . . . . 2.64 110.544 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.18 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.612 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.22 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.68 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.32 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 0.72 108.584 -178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.452 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 1.9 111.699 -173.1 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.694 HG12 HD21 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 0.56 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.519 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 1.79 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 2.88 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.489 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.71 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.799 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 0.3 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 1.81 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 0.69 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.34 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.431 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.21 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.49 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.71 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.36 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.23 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 0.49 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.44 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 0.2 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.503 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.57 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.06 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 0.27 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 1.86 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.433 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.11 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.56 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.566 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.95 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.0 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.879 ' HG3' HG22 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.44 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.01 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.888 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 0.37 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 1.77 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 1.47 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 1.96 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.465 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.26 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.44 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.04 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 0.74 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.15 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.74 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.4 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.888 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.33 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 0.65 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.03 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.889 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.28 109.29 176.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 1.33 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.34 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.889 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.51 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 1.57 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 0.92 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.27 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 0.81 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 1.5 110.959 179.709 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.324 -0.621 . . . . 2.64 109.324 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.18 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.22 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.68 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.32 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.584 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 0.72 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 1.9 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HB3' ' A' ' 48' ' ' TRP . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 0.56 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.586 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 1.79 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 2.88 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.71 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.81 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 0.3 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 1.81 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 0.69 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.34 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.21 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.49 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.71 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.36 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.23 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 0.49 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.574 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.44 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.518 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 0.2 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.44 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.57 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.06 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.748 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 0.27 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.699 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 1.86 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.11 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.56 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.95 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.0 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.748 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.44 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.594 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.01 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.788 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 0.37 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.582 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 1.77 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 1.47 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 1.96 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' ARG . 88.7 m-70 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.26 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.44 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.04 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 0.74 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.582 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.15 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.4 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.33 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 0.65 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.594 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.03 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.505 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.835 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.28 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 1.33 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.34 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.835 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.51 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 1.57 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 0.92 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.27 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.505 HD21 ' HD3' ' A' ' 30' ' ' ARG . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 0.81 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 1.5 110.337 177.4 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.009 -0.738 . . . . 2.64 109.009 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.853 HD12 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.18 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 3.4 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.22 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.68 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.32 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.853 ' HB3' HD12 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 0.72 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.632 HD13 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 1.9 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.838 HG13 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 0.56 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.631 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 1.79 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.599 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 2.88 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.71 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 0.3 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 1.81 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 0.69 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.34 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.21 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.49 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.451 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.71 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.36 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.23 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 0.49 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.53 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.44 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 0.2 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.428 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.57 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.63 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.06 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.645 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 0.27 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 1.86 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.594 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.11 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.56 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.95 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.485 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.0 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HD3' HG22 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.44 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.627 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.01 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.618 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 0.37 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 1.77 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 1.47 110.135 -174.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 1.96 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.26 111.525 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.44 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HG2' ' OH ' ' A' ' 28' ' ' TYR . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.04 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' HA ' ' A' ' 41' ' ' VAL . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 0.74 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HD3' HD13 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.15 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.645 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.4 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.597 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.33 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 0.65 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.03 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.879 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.28 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 1.33 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.34 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.879 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.51 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 1.57 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.659 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 0.92 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.594 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.27 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 0.81 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 1.5 110.29 177.623 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 120.822 0.344 . . . . 5.32 110.613 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 2' ' ' GLN . 9.1 mm-40 -80.72 96.36 6.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.139 0.495 . . . . 4.42 110.237 176.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -107.03 127.29 53.33 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.742 -0.663 . . . . 3.38 109.638 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -102.99 140.24 37.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 2.64 111.058 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -133.99 168.76 18.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.287 -0.87 . . . . 1.18 110.16 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.556 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.8 pt20 -102.44 164.96 14.65 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 108.788 -0.819 . . . . 1.22 108.788 176.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.556 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 68.0 Cg_exo -38.65 -45.3 2.41 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.406 2.737 . . . . 0.68 113.728 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -102.65 101.82 11.97 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.962 -0.695 . . . . 1.32 109.907 175.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 m -164.15 176.35 9.33 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.176 -0.92 . . . . 0.72 108.924 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.849 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -103.13 115.31 30.34 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.714 0.768 . . . . 1.9 111.507 -175.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.979 HG22 ' HB3' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -108.91 165.32 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.82 -1.082 . . . . 0.56 109.496 178.396 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.5 t70 -121.9 166.54 14.25 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.653 -0.129 . . . . 1.99 110.653 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 mt -52.69 -44.22 66.11 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.428 0.529 . . . . 1.79 112.428 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' OD1' ' A' ' 12' ' ' ASP . 39.8 mttp -57.84 -40.5 80.23 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.86 0.838 . . . . 2.88 108.994 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.427 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 11.9 t80 -60.93 -52.59 64.4 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.246 -1.343 . . . . 0.71 110.247 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.748 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -53.29 -45.99 56.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.3 110.914 177.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 84.4 mtp -63.71 -34.79 78.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.462 -0.335 . . . . 1.81 111.171 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.9 -42.88 76.29 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.192 0.52 . . . . 0.69 110.767 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -64.14 -40.74 96.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.171 -0.922 . . . . 1.34 111.455 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.538 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 56.5 p -100.36 -42.71 6.52 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.465 0.543 . . . . 1.21 112.465 -172.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.95 12.17 64.19 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.072 -0.585 . . . . 0.49 111.688 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 97.4 m-85 -118.27 -177.51 3.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.81 0.338 . . . . 0.71 111.403 -175.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -92.51 156.33 23.21 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.862 -0.608 . . . . 0.36 113.275 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.642 ' HA ' HD12 ' A' ' 27' ' ' ILE . 58.4 mttp -48.26 -45.56 34.68 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.524 0.73 . . . . 2.23 112.687 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.9 t -53.98 -46.38 71.69 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.158 -0.474 . . . . 0.49 111.132 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.665 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.1 t80 -60.0 -42.09 93.51 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.755 -0.657 . . . . 0.44 110.237 177.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' A' ' 24' ' ' LYS . 68.4 mt -55.81 -62.58 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.612 . . . . 0.2 111.298 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.7 m-85 -56.5 -41.38 76.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.319 -0.4 . . . . 0.57 111.267 -174.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -67.69 -53.5 27.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.074 0.464 . . . . 0.64 110.979 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.665 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -65.49 -40.64 93.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.701 -0.681 . . . . 1.06 111.911 -173.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.926 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -69.96 -37.81 73.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.155 -0.218 . . . . 0.27 110.543 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.93 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 50.4 mtmt -57.72 -44.77 86.19 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 120.461 -0.496 . . . . 1.86 109.982 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 40.9 t -67.11 -25.6 66.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 1.11 111.244 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.54 -69.56 1.24 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.961 -0.638 . . . . 0.56 111.766 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -159.54 31.39 0.19 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.984 0.421 . . . . 0.95 110.54 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 86.5 mt 63.67 119.21 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.764 -176.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.93 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 23.4 Cg_exo -61.17 126.87 20.48 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.593 2.195 . . . . 0.44 113.325 -175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 11.4 mptt -84.82 -11.27 56.05 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.543 -0.91 . . . . 1.01 108.543 171.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -38.5 146.21 0.07 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.586 -1.188 . . . . 0.37 112.339 173.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 7.0 mmmm -99.95 81.29 2.41 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.392 -0.966 . . . . 1.77 108.392 -173.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.2 p -104.77 125.53 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 CA-C-N 115.368 -0.833 . . . . 1.47 109.969 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.56 -26.58 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.11 -0.495 . . . . 1.96 111.166 -174.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 45' ' ' ARG . 6.1 t-160 -134.25 52.59 2.05 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.025 0.44 . . . . 3.26 110.016 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -29.54 0.79 Allowed Glycine 0 CA--C 1.521 0.459 0 CA-C-N 115.835 -0.62 . . . . 1.44 112.613 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.463 ' H ' ' C ' ' A' ' 43' ' ' HIS . 81.5 mtp180 -143.35 170.68 15.32 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 5.04 108.678 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 172.2 -91.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 O-C-N 124.56 1.163 . . . . 0.74 109.904 171.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 58.1 mtm180 -143.83 134.1 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 3.15 109.275 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.979 ' HB3' HG22 ' A' ' 11' ' ' VAL . 1.7 t-105 -107.53 142.36 37.54 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.392 -0.596 . . . . 0.4 109.392 -176.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 46.7 mt -87.8 127.85 35.33 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.348 0.594 . . . . 1.33 109.883 177.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.706 -0.679 . . . . 0.65 111.127 -175.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.5 ptp180 -49.9 -43.63 49.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 1.03 111.214 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.571 ' HB3' HG23 ' A' ' 31' ' ' ILE . 46.7 m-20 -61.16 -31.33 71.06 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.79 110.614 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 10.8 m170 -68.94 -48.62 62.78 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.614 -0.884 . . . . 0.28 108.614 175.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.7 t -56.17 -45.68 79.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.509 -0.769 . . . . 1.33 110.549 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.583 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.9 mt-10 -72.24 -41.23 67.04 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.257 -0.429 . . . . 1.34 111.452 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.817 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -65.06 -49.25 70.83 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 121.015 -0.274 . . . . 0.51 110.804 176.39 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -53.3 -36.88 61.7 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 116.19 -0.459 . . . . 1.57 110.307 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.583 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 10.2 t30 -53.27 -46.83 69.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.93 -1.032 . . . . 0.92 111.57 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 2.6 pttp -74.41 -35.58 63.42 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.927 -0.309 . . . . 1.27 110.637 -174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.57 HD12 ' HE1' ' A' ' 56' ' ' PHE . 36.4 mt -74.47 -39.64 62.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.895 0.379 . . . . 0.81 111.115 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.86 -31.57 72.26 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.619 . . . . 1.5 110.587 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.7 t -72.01 -42.06 66.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.586 -0.734 . . . . 1.84 110.706 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -84.86 -17.87 36.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.382 -0.372 . . . . 6.09 111.452 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 59.68 73.35 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.81 -0.632 . . . . 3.75 110.969 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -74.32 139.96 44.55 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.189 0.518 . . . . 4.5 110.658 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.525 -1.153 . . . . 6.88 111.461 -179.278 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.788 ' SD ' ' HG2' ' A' ' 2' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 109.359 -0.608 . . . . 5.32 109.359 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.788 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 19.4 pt20 172.82 -36.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.601 -0.889 . . . . 4.42 108.601 175.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -104.29 102.41 12.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.397 -0.964 . . . . 3.38 108.397 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -105.02 137.36 42.9 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.274 -0.639 . . . . 2.64 109.274 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.609 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -148.79 165.52 31.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.405 0.621 . . . . 1.18 112.18 -173.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.57 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.1 pt20 -114.36 167.08 10.19 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 114.886 -1.052 . . . . 1.22 108.563 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.677 ' HA ' ' HD2' ' A' ' 50' ' ' TYR . 17.5 Cg_exo -32.37 -45.45 0.23 Allowed 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 123.986 3.124 . . . . 0.68 114.496 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -101.64 103.3 14.1 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.867 -0.733 . . . . 1.32 109.907 175.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 6.9 t -175.27 176.6 2.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.23 -0.895 . . . . 0.72 109.016 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.25 120.13 40.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 1.9 111.657 -173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.609 HG12 HD21 ' A' ' 5' ' ' LEU . 16.8 m -105.52 165.18 3.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.218 -0.901 . . . . 0.56 109.389 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG13 ' A' ' 16' ' ' ILE . 9.0 m-20 -110.49 165.68 11.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.667 -0.242 . . . . 1.99 111.224 -179.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 13' ' ' LEU . 4.4 mm? -59.93 -48.72 80.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.945 0.402 . . . . 1.79 111.155 178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.4 tttp -60.59 -33.73 73.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.629 -0.714 . . . . 2.88 109.884 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 43.0 t80 -61.79 -49.58 75.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.91 -1.041 . . . . 0.71 110.642 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.796 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.5 mt -52.24 -48.4 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 CA-C-O 121.172 0.511 . . . . 0.3 110.522 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 75.3 mtp -60.24 -30.21 69.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 1.81 110.832 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.95 -52.33 25.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.254 -0.43 . . . . 0.69 111.246 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -72.74 -18.67 61.49 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 111.777 0.288 . . . . 1.34 111.777 -174.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.912 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 41.5 p -103.24 -52.43 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.562 0.579 . . . . 1.21 112.562 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.39 13.07 55.16 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.086 -0.805 . . . . 0.49 111.086 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.912 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.6 m-85 -116.75 177.25 4.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.382 . . . . 0.71 110.987 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -99.18 165.19 20.57 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.909 -0.587 . . . . 0.36 112.165 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' HD12 ' A' ' 27' ' ' ILE . 65.9 pttt -47.06 -37.61 9.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.177 0.806 . . . . 2.23 113.177 -176.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.8 t -57.05 -47.17 81.59 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.925 0.393 . . . . 0.49 110.831 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -61.23 -46.15 91.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.495 -0.557 . . . . 0.44 109.495 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.635 HD12 ' HA ' ' A' ' 24' ' ' LYS . 77.4 mt -54.69 -58.93 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.763 -0.653 . . . . 0.2 111.427 -175.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 2.2 m-85 -58.29 -44.5 88.52 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.203 -0.453 . . . . 0.57 111.303 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.58 -46.33 66.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.157 0.503 . . . . 0.64 110.364 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -65.55 -41.52 92.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.508 -0.769 . . . . 1.06 112.162 -175.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.579 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -72.85 -37.65 55.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 121.095 -0.242 . . . . 0.27 110.768 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 55.1 mttp -58.58 -40.36 82.91 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.386 0.612 . . . . 1.86 109.693 170.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 30' ' ' ARG . 33.4 t -65.27 -30.22 71.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.774 -1.103 . . . . 1.11 111.22 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.08 -74.22 0.43 Allowed Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.008 -0.615 . . . . 0.56 111.901 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.04 33.4 0.21 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.898 0.38 . . . . 0.95 111.103 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.0 mt 61.44 106.56 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.498 ' HD3' HG22 ' A' ' 31' ' ' ILE . 6.6 Cg_endo -54.33 133.51 56.38 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.703 2.269 . . . . 0.44 113.251 -174.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.52 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -92.26 -9.5 41.89 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.377 -0.828 . . . . 1.01 109.243 176.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.28 157.74 0.04 OUTLIER 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.187 -0.915 . . . . 0.37 112.753 175.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -104.37 82.75 1.97 Allowed 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.833 0.825 . . . . 1.77 109.303 -176.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -105.14 110.0 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 CA-C-N 114.279 -1.328 . . . . 1.47 110.547 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -104.44 -28.73 2.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.079 -0.51 . . . . 1.96 111.018 -175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -123.19 41.06 3.56 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.823 -0.351 . . . . 3.26 111.363 -175.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.91 -28.72 2.15 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 121.168 -0.539 . . . . 1.44 112.032 -178.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -148.23 145.63 28.32 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.225 -0.658 . . . . 5.04 109.225 174.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.77 -92.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.231 0.332 . . . . 0.74 110.599 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HD3' HD13 ' A' ' 10' ' ' LEU . 84.0 mtt180 -137.05 130.7 31.73 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 108.842 -0.799 . . . . 3.15 108.842 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.718 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.57 145.21 30.63 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.505 -0.554 . . . . 0.4 109.505 -175.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 39.3 mt -86.0 137.92 32.36 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.841 -0.429 . . . . 1.33 109.841 177.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.677 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 73.5 t80 -60.34 -37.28 80.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.65 110.432 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.598 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 14.9 ptp180 -47.78 -43.03 27.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 1.03 111.64 176.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 36.8 m-20 -60.36 -33.49 72.52 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.365 0.602 . . . . 0.79 110.192 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.96 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.7 m170 -74.48 -41.92 59.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.387 -0.824 . . . . 0.28 109.371 175.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.37 -45.69 84.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.82 -0.627 . . . . 1.33 109.84 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.645 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.2 mm-40 -67.26 -50.05 61.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.758 -0.656 . . . . 1.34 110.702 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.96 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.33 -47.68 78.47 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.476 -0.329 . . . . 0.51 111.692 -177.142 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 9.8 mmmm -56.93 -36.01 69.72 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.372 0.606 . . . . 1.57 110.074 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.645 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -57.81 -43.47 85.72 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.616 -1.175 . . . . 0.92 111.207 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -33.34 65.09 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.863 0.363 . . . . 1.27 110.636 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.471 HD21 ' HD3' ' A' ' 30' ' ' ARG . 35.5 mt -66.56 -40.79 89.2 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.963 -0.384 . . . . 0.81 109.963 174.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 tp -66.78 -37.56 84.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.293 -0.867 . . . . 1.5 110.785 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.2 t -58.21 -38.27 76.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.715 -0.675 . . . . 1.84 110.896 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -94.68 -96.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.479 -0.328 . . . . 6.09 111.46 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -169.13 50.57 0.04 OUTLIER 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.631 -0.507 . . . . 3.75 109.631 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.6 43.39 12.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.137 -0.938 . . . . 4.5 109.223 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 CA-C-O 117.987 -1.452 . . . . 6.88 110.652 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.908 0.385 . . . . 5.32 110.603 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -74.78 144.33 43.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.58 -0.526 . . . . 4.42 109.58 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -104.35 134.59 47.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.244 -0.434 . . . . 3.38 110.507 -173.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -116.89 133.95 55.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.297 0.57 . . . . 2.64 111.672 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 9' ' ' SER . 0.5 OUTLIER -149.97 167.57 26.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.999 -1.0 . . . . 1.18 108.372 176.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.9 pt20 -101.5 164.33 16.14 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.152 -0.684 . . . . 1.22 109.152 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.558 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.3 Cg_exo -37.35 -39.09 0.57 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.83 3.02 . . . . 0.68 113.858 -177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -101.71 102.44 13.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.542 0.686 . . . . 1.32 109.9 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.646 ' HB3' HD12 ' A' ' 5' ' ' LEU . 9.2 t -177.0 174.2 1.74 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 107.422 -1.325 . . . . 0.72 107.422 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.583 HD22 HH11 ' A' ' 47' ' ' ARG . 3.3 pp -103.17 120.81 41.41 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.882 0.848 . . . . 1.9 111.075 -174.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.569 HG21 ' CE1' ' A' ' 53' ' ' HIS . 34.0 m -104.38 160.44 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.424 -1.262 . . . . 0.56 108.974 173.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.503 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -104.91 164.69 11.6 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 121.148 -0.221 . . . . 1.99 110.427 -176.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.23 -41.64 97.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.911 0.386 . . . . 1.79 110.038 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.25 -36.0 78.81 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.641 -0.709 . . . . 2.88 109.215 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -62.63 -48.3 79.98 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.025 -0.989 . . . . 0.71 110.466 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' ILE . 2.3 mt -54.41 -40.24 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 121.039 0.447 . . . . 0.3 111.138 176.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 67.7 mtt -63.69 -40.16 96.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 1.81 110.583 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.39 -27.37 64.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.177 0.513 . . . . 0.69 110.825 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -62.73 -49.02 76.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.342 -0.845 . . . . 1.34 110.532 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.478 ' HB ' ' CD1' ' A' ' 22' ' ' PHE . 7.4 p -112.34 -42.88 3.6 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.156 0.428 . . . . 1.21 112.156 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.86 12.27 16.67 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.97 -0.633 . . . . 0.49 112.141 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 20' ' ' THR . 77.6 m-85 -115.32 169.13 9.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.85 0.357 . . . . 0.71 110.949 -175.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.79 162.95 45.43 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.783 -0.644 . . . . 0.36 112.854 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' HD12 ' A' ' 27' ' ' ILE . 46.3 pttt -50.09 -36.6 30.14 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.413 0.894 . . . . 2.23 113.413 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.5 t -55.28 -42.06 73.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.978 0.418 . . . . 0.49 110.706 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 12.1 t80 -63.26 -54.1 42.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.841 -0.618 . . . . 0.44 109.937 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.614 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.8 mt -49.56 -62.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.276 -0.875 . . . . 0.2 111.933 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 1.009 ' HE2' ' HG3' ' A' ' 45' ' ' ARG . 18.7 m-85 -58.13 -27.67 63.98 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.286 -0.415 . . . . 0.57 111.823 -171.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.27 -44.35 17.85 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.299 -0.561 . . . . 0.64 109.882 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 13.5 mmp_? -60.8 -45.95 92.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.522 -0.763 . . . . 1.06 110.91 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.677 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -76.58 -45.07 33.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.865 -0.607 . . . . 0.27 111.056 -174.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 25.0 mmtt -58.25 -43.69 87.99 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.875 0.369 . . . . 1.86 111.829 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.1 t -80.23 -20.63 44.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.833 -0.622 . . . . 1.11 111.065 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.34 -68.43 1.67 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.15 -0.548 . . . . 0.56 112.091 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.637 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 15.2 t70 -166.73 68.49 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.313 -0.254 . . . . 0.95 110.313 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mp 33.76 84.34 0.18 Allowed Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 124.755 1.284 . . . . 1.0 112.993 169.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 4.5 Cg_endo -47.37 131.51 18.69 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.45 2.767 . . . . 0.44 113.875 -174.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.609 ' HB2' HD12 ' A' ' 49' ' ' LEU . 10.6 mptt -90.75 -0.01 57.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.362 -0.836 . . . . 1.01 109.4 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.549 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -34.54 148.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.931 -1.031 . . . . 0.37 112.911 171.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.722 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -97.47 91.48 5.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.607 -0.724 . . . . 1.77 109.852 -175.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.662 HG21 HH11 ' A' ' 45' ' ' ARG . 81.3 t -100.43 105.32 17.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.303 -0.862 . . . . 1.47 110.973 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -94.76 -33.04 4.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.181 0.515 . . . . 1.96 109.657 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -167.34 114.07 0.76 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.807 -0.633 . . . . 3.26 110.458 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.48 44.39 41.45 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.965 -0.561 . . . . 1.44 113.443 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 1.009 ' HG3' ' HE2' ' A' ' 28' ' ' TYR . 32.2 mmt180 51.24 64.88 1.66 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.858 0.361 . . . . 5.04 110.83 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.48 -84.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.027 0.751 . . . . 0.74 113.027 -170.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.583 HH11 HD22 ' A' ' 10' ' ' LEU . 57.9 mtm180 -106.47 137.08 45.11 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.717 -0.475 . . . . 3.15 109.717 -177.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.677 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -107.85 149.89 27.71 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.702 -0.481 . . . . 0.4 109.702 -179.661 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.722 HD11 ' HE3' ' A' ' 40' ' ' LYS . 37.6 mt -94.2 145.46 24.7 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 120.962 0.41 . . . . 1.33 110.044 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -67.49 -34.53 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.65 110.245 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.0 ptp180 -49.07 -42.24 38.06 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.154 -0.476 . . . . 1.03 111.741 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.458 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.1 m-20 -65.22 -29.73 70.55 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.303 0.573 . . . . 0.79 110.11 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.979 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 18.3 m170 -72.25 -40.27 67.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.28 109.315 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 81.4 m -54.15 -45.08 71.92 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.58 0.55 . . . . 1.33 110.199 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.637 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 27.7 mm-40 -68.33 -48.46 64.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.681 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.979 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.68 -46.35 82.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.662 -0.415 . . . . 0.51 111.001 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -58.08 -32.59 68.19 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.306 0.574 . . . . 1.57 110.421 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 25.4 t30 -62.0 -57.91 9.88 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.978 -1.01 . . . . 0.92 111.533 -176.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -74.5 -24.31 58.97 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.325 -0.55 . . . . 1.27 110.903 -175.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' CD ' ' A' ' 30' ' ' ARG . 19.6 mt -72.73 -33.49 66.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.874 0.369 . . . . 0.81 110.779 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.4 tp -75.23 -47.21 29.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.766 -0.652 . . . . 1.5 110.813 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.0 m -76.85 -40.22 48.49 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.082 -0.508 . . . . 1.84 111.213 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -117.99 78.81 1.28 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.497 -0.556 . . . . 6.09 109.497 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.88 100.01 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.694 -0.685 . . . . 3.75 111.944 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -125.86 15.15 8.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.398 0.618 . . . . 4.5 109.68 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 CA-C-O 118.817 -0.991 . . . . 6.88 110.938 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 tpp . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.718 0.294 . . . . 5.32 110.927 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -79.99 132.12 35.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.172 0.51 . . . . 4.42 111.377 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -118.81 121.36 39.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 3.38 110.025 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -103.56 105.34 15.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.113 0.482 . . . . 2.64 109.996 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.651 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -104.06 165.6 10.94 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.693 -0.685 . . . . 1.18 111.418 -177.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.597 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.3 pt20 -119.37 166.71 13.77 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.173 -1.047 . . . . 1.22 108.173 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 23.1 Cg_exo -28.45 -48.75 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 124.361 3.374 . . . . 0.68 115.014 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -101.82 104.0 14.74 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.895 -0.722 . . . . 1.32 109.877 177.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -171.15 170.95 5.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.176 -0.92 . . . . 0.72 109.112 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.811 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -103.87 113.9 27.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.719 0.771 . . . . 1.9 111.602 -173.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.651 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.3 m -102.9 165.73 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.79 -1.096 . . . . 0.56 109.159 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.659 ' O ' HG13 ' A' ' 16' ' ' ILE . 3.4 m-20 -114.66 162.67 16.48 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.062 -0.255 . . . . 1.99 111.165 177.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.28 -39.78 84.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.469 . . . . 1.79 110.652 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.21 -47.23 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.377 -0.829 . . . . 2.88 109.359 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.51 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 79.8 t80 -61.35 -46.51 89.93 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.739 -1.119 . . . . 0.71 111.011 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.6 mt -50.16 -40.85 17.85 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 120.572 0.225 . . . . 0.3 110.902 176.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.9 mtt -57.45 -39.83 77.14 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.431 -0.35 . . . . 1.81 110.751 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.95 -43.15 65.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.092 0.472 . . . . 0.69 110.797 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -67.47 -24.61 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.541 -0.754 . . . . 1.34 111.44 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.634 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.6 p -99.08 -50.96 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.258 0.552 . . . . 1.21 111.087 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.36 3.2 61.56 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.618 -0.993 . . . . 0.49 110.618 -171.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -127.36 -175.74 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.577 -0.312 . . . . 0.71 110.84 -173.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -97.61 176.43 31.13 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.913 -0.66 . . . . 0.36 112.898 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HA ' HD12 ' A' ' 27' ' ' ILE . 45.2 mtmt -45.2 -49.61 12.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.326 0.65 . . . . 2.23 112.537 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.3 t -53.27 -46.24 69.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.933 -0.576 . . . . 0.49 111.934 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.53 -44.31 94.61 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.026 -0.361 . . . . 0.44 110.026 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CG2' HG21 ' A' ' 16' ' ' ILE . 77.7 mt -56.99 -62.11 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.2 111.28 -177.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -57.52 -42.12 82.2 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.304 -0.407 . . . . 0.57 110.858 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -67.52 -52.94 33.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.64 111.232 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HD3' HD21 ' A' ' 60' ' ' LEU . 2.6 tpm_? -64.88 -39.72 93.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 1.06 112.06 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.586 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.9 mp -74.03 -39.28 50.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 121.28 -0.168 . . . . 0.27 110.752 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -59.56 -38.59 81.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.687 0.756 . . . . 1.86 109.667 170.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.8 t -69.13 -20.62 64.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.685 -1.143 . . . . 1.11 111.207 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.16 -65.68 2.52 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.155 -0.545 . . . . 0.56 112.076 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -163.54 27.25 0.08 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.066 0.46 . . . . 0.95 110.592 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.3 mt 60.59 106.84 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 115.822 -0.627 . . . . 1.0 110.642 -174.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.82 131.54 42.51 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.213 2.609 . . . . 0.44 113.653 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.578 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.4 mptp? -89.05 -5.31 57.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.043 -0.98 . . . . 1.01 108.984 176.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.787 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.32 158.13 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.751 -1.113 . . . . 0.37 112.659 172.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.2 mptp? -102.21 82.17 2.17 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.591 -0.892 . . . . 1.77 108.591 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 p -118.13 131.33 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.971 -1.013 . . . . 1.47 110.603 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 tp -133.32 -32.77 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.71 -0.396 . . . . 1.96 111.393 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.401 ' C ' ' H ' ' A' ' 45' ' ' ARG . 57.1 m170 -97.78 24.33 6.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.599 -0.273 . . . . 3.26 110.822 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.74 -26.09 4.31 Favored Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.745 -0.74 . . . . 1.44 111.298 -174.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 43' ' ' HIS . 7.7 ptm180 -144.46 141.03 29.3 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.189 -0.671 . . . . 5.04 109.189 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.74 -94.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.105 0.253 . . . . 0.74 110.828 176.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.2 mtm180 -135.0 122.75 22.28 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.079 -0.712 . . . . 3.15 109.079 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.787 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -104.8 144.16 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.427 -0.351 . . . . 0.4 110.09 -174.305 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.687 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 44.0 mt -88.18 139.24 30.7 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.98 0.419 . . . . 1.33 110.204 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -63.95 -32.48 74.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.65 110.432 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.578 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.4 ptp180 -50.12 -40.55 46.45 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.268 -0.424 . . . . 1.03 111.786 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 28.2 m-20 -63.4 -34.16 77.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.79 109.864 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.924 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.2 m170 -71.79 -39.8 69.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.179 -0.919 . . . . 0.28 109.096 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.8 t -54.71 -44.51 73.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.775 -0.648 . . . . 1.33 110.195 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 65.1 mm-40 -66.8 -49.29 66.31 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.865 0.365 . . . . 1.34 111.092 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.924 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.73 -48.72 75.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.517 -0.473 . . . . 0.51 110.761 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -58.63 -31.12 67.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.11 0.481 . . . . 1.57 110.716 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 16.0 t30 -61.26 -58.53 7.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.861 -1.063 . . . . 0.92 111.288 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -78.37 -19.45 53.34 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.558 -0.457 . . . . 1.27 111.323 -174.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.466 HD23 HD21 ' A' ' 65' ' ' ASN . 39.0 mt -77.97 -25.84 48.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.879 0.371 . . . . 0.81 110.333 173.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.5 -32.8 70.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.355 0.598 . . . . 1.5 109.425 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -84.71 -9.01 58.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.236 -0.893 . . . . 1.84 110.495 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 44.57 40.92 4.35 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.808 -1.087 . . . . 6.09 112.796 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 60.58 1.38 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.149 0.5 . . . . 3.75 110.661 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.466 HD21 HD23 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -149.41 27.78 0.82 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 4.5 110.395 -179.355 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.797 -1.002 . . . . 6.88 111.437 -179.669 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 5.32 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -139.31 143.95 38.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.456 -0.338 . . . . 4.42 110.759 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -104.16 104.63 14.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.147 -0.479 . . . . 3.38 110.055 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -104.49 145.06 30.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.775 0.321 . . . . 2.64 110.141 174.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.48 160.21 34.41 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.643 -0.708 . . . . 1.18 110.395 177.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.561 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 18.6 pt20 -108.97 166.63 10.44 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 108.901 -0.777 . . . . 1.22 108.901 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 46.0 Cg_exo -36.48 -47.05 1.26 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.426 2.751 . . . . 0.68 113.345 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -101.29 103.3 14.28 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.293 -0.632 . . . . 1.32 109.293 175.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -168.06 -167.28 0.81 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.003 -1.11 . . . . 0.72 108.003 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 1.5 pt? -123.28 114.14 19.83 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.85 0.833 . . . . 1.9 112.472 -174.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.629 HG21 ' CE1' ' A' ' 53' ' ' HIS . 12.2 m -103.43 161.62 4.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 114.636 -1.165 . . . . 0.56 107.997 167.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.566 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.91 169.26 12.25 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.751 -0.38 . . . . 1.99 110.682 -178.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 92.7 mt -46.01 -48.79 16.67 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.632 0.583 . . . . 1.79 112.416 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -58.85 -41.08 86.13 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.351 0.596 . . . . 2.88 110.011 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -62.16 -51.88 66.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.905 -1.043 . . . . 0.71 111.219 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.682 HG12 ' CE1' ' A' ' 53' ' ' HIS . 3.9 mt -53.04 -46.79 54.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.143 0.497 . . . . 0.3 110.423 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.4 mtp -60.9 -37.08 81.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.772 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.21 -43.62 81.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.047 -0.524 . . . . 0.69 111.373 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -66.27 -42.37 88.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.803 0.335 . . . . 1.34 111.479 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.701 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 35.6 p -97.24 -40.28 8.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.667 0.617 . . . . 1.21 112.667 -171.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.34 20.89 43.3 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.796 -0.716 . . . . 0.49 111.716 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.701 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 78.1 m-85 -123.09 -176.62 3.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.618 0.246 . . . . 0.71 110.821 -178.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.12 169.85 18.11 Favored Glycine 0 CA--C 1.521 0.425 0 CA-C-N 116.052 -0.522 . . . . 0.36 113.394 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -48.03 -40.66 23.51 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.853 1.057 . . . . 2.23 113.853 -176.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.9 t -58.36 -43.71 88.49 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.012 0.434 . . . . 0.49 110.898 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.656 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.5 t80 -61.27 -45.62 93.72 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.806 177.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.59 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.0 mt -58.01 -59.64 3.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.413 -0.812 . . . . 0.2 111.383 -177.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -58.89 -40.81 85.58 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.57 111.785 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.89 -51.42 48.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.328 0.585 . . . . 0.64 110.493 176.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.656 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.1 -40.15 96.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.468 -0.787 . . . . 1.06 111.786 -173.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.48 HG21 ' CZ2' ' A' ' 48' ' ' TRP . 1.7 mp -71.84 -47.5 55.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.427 -0.352 . . . . 0.27 110.953 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.703 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 92.7 mttt -58.35 -37.22 74.75 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.321 0.582 . . . . 1.86 110.468 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 25.2 t -85.9 -4.73 59.24 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.3 -0.864 . . . . 1.11 110.865 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' A' ' 59' ' ' LYS . . . -73.12 -59.54 4.22 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.86 -0.896 . . . . 0.56 110.86 177.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -168.74 35.49 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.95 -0.389 . . . . 0.95 109.95 171.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 75.0 mt 66.75 126.91 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.052 -177.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.703 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 72.7 Cg_exo -49.9 118.91 4.22 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.282 2.655 . . . . 0.44 114.22 -172.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' O ' HD22 ' A' ' 49' ' ' LEU . 57.4 mmtt -80.83 -24.12 38.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.444 -0.798 . . . . 1.01 109.366 172.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 48' ' ' TRP . . . -48.65 158.2 0.32 Allowed 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 114.784 -1.098 . . . . 0.37 113.231 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -105.64 84.31 2.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.391 -0.822 . . . . 1.77 109.414 -179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 88.3 t -92.44 132.37 36.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.369 -0.832 . . . . 1.47 110.706 -176.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.541 HG22 ' HB2' ' A' ' 46' ' ' ALA . 8.2 tp -115.55 -29.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.457 -0.338 . . . . 1.96 111.803 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' ARG . 14.9 t60 -144.92 59.12 1.31 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.02 0.438 . . . . 3.26 110.592 -176.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.62 -28.62 1.53 Allowed Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.005 -0.543 . . . . 1.44 111.973 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' HIS . 6.9 ptp180 -148.42 173.79 12.72 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.299 -1.0 . . . . 5.04 108.299 173.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . 175.83 -88.21 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.764 0.665 . . . . 0.74 109.974 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -140.13 130.57 25.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.656 -0.868 . . . . 3.15 108.656 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.593 ' HA ' ' CB ' ' A' ' 39' ' ' ALA . 1.1 t-105 -104.17 138.13 41.09 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.409 -0.36 . . . . 0.4 110.142 -173.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.546 HD23 ' NE ' ' A' ' 51' ' ' ARG . 3.7 mp -79.74 134.72 36.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.402 0.62 . . . . 1.33 111.24 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -64.94 -41.93 95.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.36 -0.836 . . . . 0.65 110.872 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.546 ' NE ' HD23 ' A' ' 49' ' ' LEU . 32.6 ptt180 -55.96 -36.68 68.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.048 0.451 . . . . 1.03 110.694 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 13.2 t70 -57.36 -43.7 83.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.538 -0.755 . . . . 0.79 110.623 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.793 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 19.1 m170 -61.64 -38.85 89.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.272 -0.876 . . . . 0.28 110.104 177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.0 t -55.96 -36.29 67.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.829 -0.434 . . . . 1.33 109.829 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.633 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 5.4 mm-40 -68.84 -50.95 45.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.092 0.473 . . . . 1.34 111.178 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.793 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.89 -46.53 84.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.04 0.448 . . . . 0.51 110.285 178.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -56.01 -30.33 61.69 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.741 -0.663 . . . . 1.57 110.586 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.0 t30 -67.2 -51.13 57.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.621 -0.718 . . . . 0.92 110.555 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.576 ' HG2' ' HA2' ' A' ' 34' ' ' GLY . 0.0 OUTLIER -70.67 -23.8 62.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.27 110.92 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 30' ' ' ARG . 26.2 mt -77.07 -39.26 50.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.81 110.697 173.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.4 tp -72.02 -42.12 66.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.965 -0.561 . . . . 1.5 110.984 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.2 t -74.15 -51.38 15.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 1.84 111.802 -177.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -100.9 -16.15 17.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.226 0.454 . . . . 6.09 112.226 -171.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 52.46 79.79 0.11 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.022 0.439 . . . . 3.75 111.882 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -126.18 172.78 9.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 4.5 110.425 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.192 0 CA-C-O 118.658 -1.079 . . . . 6.88 111.921 -179.606 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mmm . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.709 0.29 . . . . 5.32 110.616 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -166.56 108.63 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.802 0.334 . . . . 4.42 110.378 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -108.76 120.47 42.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.227 -0.657 . . . . 3.38 109.227 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -103.23 134.76 46.1 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.068 0.461 . . . . 2.64 111.229 -175.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.683 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -117.93 157.67 26.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.597 -0.729 . . . . 1.18 110.585 176.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.648 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.7 pt20 -108.25 166.46 10.86 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 115.861 -0.608 . . . . 1.22 109.894 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.648 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 17.6 Cg_exo -32.26 -50.74 0.34 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 124.238 3.292 . . . . 0.68 114.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -102.05 103.01 13.58 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.016 -0.674 . . . . 1.32 109.391 175.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t -164.07 175.14 10.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.242 -0.89 . . . . 0.72 109.31 -176.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.415 HD22 ' HD2' ' A' ' 47' ' ' ARG . 81.0 mt -104.93 105.69 15.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.312 0.577 . . . . 1.9 111.472 -173.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.683 HG12 ' CD2' ' A' ' 5' ' ' LEU . 3.1 m -102.79 165.54 2.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.367 -0.833 . . . . 0.56 109.002 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.612 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.0 t70 -122.67 163.72 19.57 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.764 -0.374 . . . . 1.99 111.301 -178.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.471 HD21 ' HE3' ' A' ' 24' ' ' LYS . 57.2 tp -53.29 -39.97 64.36 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.385 0.428 . . . . 1.79 111.119 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -57.41 -51.54 69.02 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.589 0.709 . . . . 2.88 109.395 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.56 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 91.8 t80 -59.65 -45.96 90.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.492 -1.231 . . . . 0.71 111.389 -176.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 12' ' ' ASP . 5.7 mt -51.12 -35.24 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.136 0.494 . . . . 0.3 111.53 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 57.6 mtt -64.97 -32.29 73.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.288 -0.415 . . . . 1.81 110.116 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.77 -30.34 65.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.69 111.141 175.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.463 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 2.1 m-20 -60.07 -37.18 79.13 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.256 0.551 . . . . 1.34 110.405 178.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.729 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 21.2 p -122.18 -62.48 1.38 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.857 0.688 . . . . 1.21 112.857 -172.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.63 23.34 3.74 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.933 -0.867 . . . . 0.49 110.933 -172.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.729 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 98.9 m-85 -121.99 171.11 9.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.637 0.256 . . . . 0.71 110.665 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.09 165.52 39.69 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.191 -0.528 . . . . 0.36 112.404 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 10.4 ptpp? -48.12 -35.1 10.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.034 0.753 . . . . 2.23 113.034 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.1 t -54.71 -48.56 72.33 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.619 0.247 . . . . 0.49 111.161 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HE1' HG21 ' A' ' 20' ' ' THR . 13.9 t80 -62.21 -41.13 98.09 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.44 -0.345 . . . . 0.44 110.112 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.4 mt -58.65 -63.97 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.748 -0.66 . . . . 0.2 111.32 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.685 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 5.3 m-85 -58.16 -38.45 76.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.528 -0.306 . . . . 0.57 111.202 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -68.19 -54.13 20.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.101 0.477 . . . . 0.64 110.884 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.597 ' HD3' HD21 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -65.39 -39.89 92.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.693 -0.685 . . . . 1.06 111.623 -172.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.482 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -70.53 -35.2 60.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 121.063 -0.255 . . . . 0.27 110.604 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 20.8 mttp -57.92 -49.21 77.53 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.053 -0.659 . . . . 1.86 109.909 171.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -66.34 -24.93 66.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.394 -0.821 . . . . 1.11 111.334 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.29 -69.89 1.16 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.155 -0.545 . . . . 0.56 111.986 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -158.72 26.67 0.23 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.95 110.741 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 84.2 mt 62.53 108.36 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.446 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.785 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 9.2 Cg_endo -53.16 129.57 34.07 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.41 2.74 . . . . 0.44 113.523 -173.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HB2' HD12 ' A' ' 49' ' ' LEU . 1.4 mptp? -88.36 -9.91 51.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.334 -0.848 . . . . 1.01 108.723 176.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -41.98 156.73 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.043 -0.98 . . . . 0.37 113.285 174.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.8 mptp? -109.87 84.45 1.93 Allowed 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.624 -0.717 . . . . 1.77 109.952 -176.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -94.29 123.01 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.646 -0.706 . . . . 1.47 109.907 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 ' HD2' ' A' ' 43' ' ' HIS . 10.0 tp -118.31 -14.59 9.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 112.097 0.406 . . . . 1.96 112.097 -175.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.676 ' HD2' HG23 ' A' ' 42' ' ' ILE . 8.6 p80 -154.81 65.28 0.66 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.475 0.655 . . . . 3.26 111.075 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.3 -30.85 0.68 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.675 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.458 ' H ' ' C ' ' A' ' 43' ' ' HIS . 1.8 ptm180 -150.75 170.67 18.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.347 -0.983 . . . . 5.04 108.347 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -179.26 -88.67 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.686 0.617 . . . . 0.74 109.782 173.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' HD22 ' A' ' 10' ' ' LEU . 23.3 ptt180 -141.19 123.53 15.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.177 0.513 . . . . 3.15 109.813 175.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.704 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.7 t-105 -101.36 145.3 29.09 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.114 -0.698 . . . . 0.4 109.114 -175.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.642 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 42.0 mt -87.44 133.33 33.76 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.147 0.499 . . . . 1.33 110.124 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -58.73 -36.03 73.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.65 110.667 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.642 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 11.0 ptp180 -47.68 -41.83 23.42 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.975 -0.557 . . . . 1.03 111.797 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.491 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 66.0 m-20 -61.07 -31.69 71.34 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.023 0.439 . . . . 0.79 110.832 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.866 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 23.5 m170 -72.96 -41.66 64.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.847 -0.797 . . . . 0.28 108.847 177.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -58.55 -47.26 84.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.791 -0.64 . . . . 1.33 110.171 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.625 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 18.5 mm-40 -64.97 -47.56 77.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 120.976 0.417 . . . . 1.34 111.284 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.866 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.64 -49.77 71.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.289 -0.414 . . . . 0.51 110.685 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HG2' ' CE2' ' A' ' 56' ' ' PHE . 23.8 mmmt -57.46 -34.94 69.53 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.18 0.514 . . . . 1.57 110.54 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.625 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.3 t30 -55.96 -41.34 74.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.74 -1.118 . . . . 0.92 111.276 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -37.34 61.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.303 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.597 HD21 ' HD3' ' A' ' 30' ' ' ARG . 41.1 mt -74.84 -23.07 58.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.437 -0.347 . . . . 0.81 111.137 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.8 -58.75 7.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.5 110.379 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.8 p -81.93 -32.6 30.78 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.149 -0.932 . . . . 1.84 111.3 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -126.15 88.19 2.8 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.771 -0.65 . . . . 6.09 111.221 -172.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.4 92.46 0.13 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.727 -0.669 . . . . 3.75 110.471 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -50.91 46.95 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.081 -0.508 . . . . 4.5 111.344 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.661 -1.077 . . . . 6.88 111.156 -173.933 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.32 110.759 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 4.42 108.994 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 3.38 110.086 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 174.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 1.84 111.1 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.09 111.632 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.88 111.816 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.798 0.333 . . . . 5.32 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -81.42 127.52 32.88 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.994 -0.743 . . . . 4.42 108.994 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -103.99 124.46 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.086 -0.338 . . . . 3.38 110.086 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -104.09 136.46 43.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.12 0.486 . . . . 2.64 109.959 174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.533 HD21 HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -154.11 165.83 34.97 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.653 -0.703 . . . . 1.18 110.503 -179.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.497 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -105.1 165.93 12.33 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.585 -0.894 . . . . 1.22 108.585 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 45.1 Cg_exo -38.07 -36.43 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.68 113.741 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -100.45 103.37 14.73 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.702 -0.799 . . . . 1.32 109.66 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.7 t -173.37 -173.79 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.917 -1.038 . . . . 0.72 109.013 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.464 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -119.82 111.82 18.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.709 0.766 . . . . 1.9 111.698 -175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 ' CE1' ' A' ' 53' ' ' HIS . 10.7 m -104.03 165.29 3.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.046 -0.979 . . . . 0.56 109.284 173.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.401 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -126.36 168.01 14.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.923 -0.311 . . . . 1.99 110.445 177.681 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 24' ' ' LYS . 96.1 mt -48.8 -42.79 37.05 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.414 0.524 . . . . 1.79 112.414 -175.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 17' ' ' MET . 95.0 mttt -58.25 -48.7 79.61 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 122.18 0.99 . . . . 2.88 109.713 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 61.0 t80 -61.53 -42.45 98.84 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.581 -1.645 . . . . 0.71 111.335 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.601 HG12 ' CE1' ' A' ' 53' ' ' HIS . 7.2 mt -53.06 -43.17 47.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 121.233 0.539 . . . . 0.3 110.673 173.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 70.7 mtm -64.52 -29.43 70.47 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.81 110.804 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.49 -39.91 77.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.382 -0.372 . . . . 0.69 110.451 175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.84 -36.36 83.65 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.973 -0.558 . . . . 1.34 111.139 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HD1' ' A' ' 22' ' ' PHE . 24.4 p -114.18 -69.76 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.566 0.58 . . . . 1.21 112.566 -173.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 117.36 22.48 4.09 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.911 -0.876 . . . . 0.49 110.911 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.727 ' HD1' ' HB ' ' A' ' 20' ' ' THR . 91.1 m-85 -126.07 -178.98 4.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.576 0.227 . . . . 0.71 110.912 -175.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -103.58 -174.87 25.98 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.913 -0.66 . . . . 0.36 113.405 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 13' ' ' LEU . 42.6 mmtm -45.35 -58.77 3.07 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.863 0.865 . . . . 2.23 113.235 -174.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.3 t -56.15 -40.92 74.58 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.967 -0.561 . . . . 0.49 112.105 -170.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 39.2 t80 -62.55 -48.23 80.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.697 -0.483 . . . . 0.44 109.697 178.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.495 ' O ' HD13 ' A' ' 31' ' ' ILE . 74.1 mt -55.53 -62.71 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.856 -0.611 . . . . 0.2 111.156 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -58.17 -38.77 77.3 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.999 -0.546 . . . . 0.57 111.308 -173.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -65.39 -50.97 63.52 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.73 0.3 . . . . 0.64 110.837 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 3.2 mmp_? -61.36 -52.73 63.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.275 -0.421 . . . . 1.06 111.15 -176.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.677 ' HA ' ' HB3' ' A' ' 56' ' ' PHE . 1.8 mp -62.72 -43.43 98.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.017 -0.538 . . . . 0.27 111.172 -173.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.05 -52.59 63.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.008 0.433 . . . . 1.86 111.258 175.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -63.16 -27.08 69.12 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.403 -0.817 . . . . 1.11 110.1 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.08 -64.34 3.72 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.178 -0.769 . . . . 0.56 111.178 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 11.2 t70 179.43 86.94 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 110.418 -0.215 . . . . 0.95 110.418 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.469 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 69.3 mt 18.39 100.25 0.02 OUTLIER Pre-proline 0 N--CA 1.479 1.024 0 O-C-N 125.296 1.622 . . . . 1.0 113.793 170.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.2 Cg_endo -54.13 135.63 64.98 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.804 2.336 . . . . 0.44 113.329 -174.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.9 mptt -92.56 -1.27 57.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.326 -0.852 . . . . 1.01 109.513 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.902 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -41.93 153.62 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.928 -1.033 . . . . 0.37 112.079 171.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.6 mptp? -102.73 84.96 2.48 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.707 0.765 . . . . 1.77 109.804 -175.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.0 89.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.666 -1.152 . . . . 1.47 110.005 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.9 tp -99.81 -18.35 6.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.999 -0.546 . . . . 1.96 110.115 -177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -140.61 57.28 1.58 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.116 -0.493 . . . . 3.26 110.566 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.3 -29.93 1.41 Allowed Glycine 0 CA--C 1.521 0.444 0 CA-C-N 115.722 -0.672 . . . . 1.44 113.48 176.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 -144.79 -68.28 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.325 -0.62 . . . . 5.04 109.325 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.42 -93.25 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.653 -0.703 . . . . 0.74 112.714 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -140.95 142.67 34.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.739 0.304 . . . . 3.15 110.538 -175.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.629 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.0 OUTLIER -113.06 153.39 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.792 -0.447 . . . . 0.4 109.792 -177.254 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.902 HD13 ' HA ' ' A' ' 39' ' ' ALA . 8.4 mp -97.6 149.72 21.93 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.283 0.563 . . . . 1.33 111.081 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -72.33 -34.93 68.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.567 -0.742 . . . . 0.65 110.175 -177.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.691 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 13.6 ptp180 -51.29 -39.36 56.66 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.03 110.847 175.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.464 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 40.4 m-20 -63.86 -27.71 69.35 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.318 0.58 . . . . 0.79 110.35 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.913 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 29.8 m170 -75.31 -36.9 61.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.92 -0.77 . . . . 0.28 108.92 175.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -61.7 -41.9 98.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 1.33 109.87 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.691 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 4.4 mm-40 -65.04 -47.59 76.83 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.709 -0.678 . . . . 1.34 110.818 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.913 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.44 -46.17 84.34 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.851 -0.339 . . . . 0.51 110.891 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -56.63 -38.5 72.2 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.246 0.546 . . . . 1.57 110.364 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.673 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 15.9 t30 -53.4 -39.98 64.72 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.847 -1.07 . . . . 0.92 111.541 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.17 -39.44 21.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.836 0.35 . . . . 1.27 110.865 -178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' CE1' ' A' ' 56' ' ' PHE . 15.8 mt -68.47 -24.76 64.73 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.614 -0.266 . . . . 0.81 111.156 177.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.83 -34.21 72.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.904 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.1 m -70.68 -17.22 62.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 1.84 111.1 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -106.26 -42.66 5.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.276 -0.42 . . . . 6.09 111.632 -175.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 60.86 94.56 0.04 OUTLIER 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.354 0.597 . . . . 3.75 110.538 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -86.66 -3.89 59.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 4.5 111.432 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.921 -0.933 . . . . 6.88 111.816 177.443 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.231 0.539 . . . . 5.32 110.032 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -106.88 144.58 33.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.948 -0.569 . . . . 4.42 110.427 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -103.34 114.02 27.96 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.741 -0.837 . . . . 3.38 108.741 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -103.31 135.81 44.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.365 0.603 . . . . 2.64 111.484 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.62 ' CD2' HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -143.9 165.95 26.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.979 -1.009 . . . . 1.18 109.951 176.154 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.623 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.7 pt20 -121.25 166.06 17.28 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.935 -0.765 . . . . 1.22 108.935 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 12.4 Cg_exo -30.59 -45.12 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 124.495 3.464 . . . . 0.68 114.907 -178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -101.56 102.62 13.38 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.765 -0.774 . . . . 1.32 109.509 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.0 t -177.67 172.33 1.76 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.89 -1.05 . . . . 0.72 108.929 -174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HB3' ' HD3' ' A' ' 47' ' ' ARG . 97.3 mt -104.16 117.71 34.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.148 0.499 . . . . 1.9 111.308 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE1' ' A' ' 53' ' ' HIS . 3.4 m -103.59 165.34 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.51 -0.768 . . . . 0.56 109.052 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.522 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.6 m-20 -114.58 166.5 11.65 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.315 0.487 . . . . 1.99 112.315 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.5 mt -54.15 -54.22 42.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.87 -0.605 . . . . 1.79 111.903 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -59.3 -32.53 70.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.334 0.588 . . . . 2.88 110.147 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.503 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 38.5 t80 -62.92 -49.54 74.39 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.362 -0.835 . . . . 0.71 110.395 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.645 HG12 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -54.25 -38.28 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.234 0.54 . . . . 0.3 110.788 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 66.6 mtt -63.83 -41.94 97.73 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.802 -0.635 . . . . 1.81 110.527 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.04 -27.45 65.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.102 0.477 . . . . 0.69 110.808 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -62.56 -47.17 85.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.487 -0.779 . . . . 1.34 110.021 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 p -118.0 -58.28 2.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 1.21 112.219 -177.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.68 23.21 1.9 Allowed Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.872 -0.603 . . . . 0.49 111.905 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 88.2 m-85 -120.65 175.83 5.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.71 111.353 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.51 167.86 31.52 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.36 113.446 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' HD12 ' A' ' 27' ' ' ILE . 23.1 pttm -47.38 -41.43 19.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.337 0.865 . . . . 2.23 113.337 -176.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.23 -42.91 82.32 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.744 0.307 . . . . 0.49 111.166 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.478 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.3 t80 -59.96 -46.39 89.59 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.825 -0.625 . . . . 0.44 109.977 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 24' ' ' LYS . 64.6 mt -58.97 -63.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.108 -0.951 . . . . 0.2 111.353 -176.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 32' ' ' LYS . 7.8 m-85 -57.68 -38.53 75.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.352 -0.385 . . . . 0.57 111.587 -173.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.47 -53.46 13.88 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.721 -0.392 . . . . 0.64 111.297 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.28 -44.86 93.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 1.06 111.518 -175.163 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.668 HG21 ' HE1' ' A' ' 48' ' ' TRP . 1.8 mp -66.44 -48.78 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.562 -0.29 . . . . 0.27 110.657 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' TYR . 31.0 mttm -58.87 -43.88 90.98 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 112.04 0.385 . . . . 1.86 112.04 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.3 m -71.59 -22.48 61.72 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.138 -0.483 . . . . 1.11 111.669 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.571 ' CA ' ' HD2' ' A' ' 59' ' ' LYS . . . -69.55 -71.18 1.03 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.827 -0.701 . . . . 0.56 112.014 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.711 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 16.0 t70 -157.63 68.87 0.53 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.296 -0.261 . . . . 0.95 110.296 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 44.4 mt 28.39 94.13 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.947 0 O-C-N 124.949 1.406 . . . . 1.0 113.401 168.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 36' ' ' LEU . 11.7 Cg_endo -53.69 140.82 65.95 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.421 2.747 . . . . 0.44 114.251 -174.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.635 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 10.0 mptt -96.64 0.71 50.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.191 -0.913 . . . . 1.01 109.291 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.857 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -44.27 155.96 0.08 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.897 -1.047 . . . . 0.37 112.559 173.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.4 mptp? -106.4 82.41 1.73 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.77 109.236 -178.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.5 t -117.46 83.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 114.877 -1.056 . . . . 1.47 109.022 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 tp -102.13 -11.98 8.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.133 0.492 . . . . 1.96 111.039 -172.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.97 17.34 23.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.844 0.354 . . . . 3.26 110.59 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.82 -29.01 4.72 Favored Glycine 0 C--O 1.228 -0.271 0 N-CA-C 111.263 -0.735 . . . . 1.44 111.263 -173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -144.56 141.84 29.76 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.262 -0.644 . . . . 5.04 109.262 172.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -169.34 -101.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.011 0.195 . . . . 0.74 111.061 176.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.724 ' HD3' ' HB3' ' A' ' 10' ' ' LEU . 35.4 mtt180 -141.92 151.09 42.29 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.08 0.467 . . . . 3.15 110.228 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.725 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -110.43 152.15 26.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.374 -0.83 . . . . 0.4 109.872 -173.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.857 HD13 ' HA ' ' A' ' 39' ' ' ALA . 6.7 mp -88.28 146.09 25.51 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.372 0.606 . . . . 1.33 110.277 175.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -69.33 -37.09 77.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.38 -0.827 . . . . 0.65 110.426 -176.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.52 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 15.7 ptp180 -50.73 -39.81 52.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 1.03 111.977 176.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.16 -28.9 69.13 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.266 0.555 . . . . 0.79 110.157 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -70.46 -37.67 74.32 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.558 -0.746 . . . . 0.28 109.314 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.0 m -56.27 -43.25 78.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.029 -0.532 . . . . 1.33 110.273 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 6.5 mm-40 -66.82 -47.87 70.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.131 -0.486 . . . . 1.34 111.194 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.954 ' HA ' ' HD3' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -66.12 -44.02 85.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.335 -0.393 . . . . 0.51 111.171 -178.15 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 11.5 mmmm -57.47 -38.81 75.1 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.255 0.55 . . . . 1.57 110.188 174.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.589 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 2.2 t30 -56.56 -42.41 78.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.809 -1.087 . . . . 0.92 111.556 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.954 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 13.0 mtpp -62.14 -49.98 73.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.987 0.899 . . . . 1.27 110.612 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 65' ' ' ASN . 15.1 mt -73.79 -19.78 60.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.487 -1.233 . . . . 0.81 111.849 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.1 tp -79.12 -37.07 39.52 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.838 -0.619 . . . . 1.5 110.512 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.0 p -86.4 -51.4 6.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.888 -0.596 . . . . 1.84 111.856 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -108.25 -5.66 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.361 0.504 . . . . 6.09 112.361 -173.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 47.94 73.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.138 0.494 . . . . 3.75 112.275 175.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.521 ' H ' HD23 ' A' ' 60' ' ' LEU . 31.3 m-80 -91.54 -165.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 4.5 110.111 -177.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.42 -1.211 . . . . 6.88 112.316 176.088 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 tpp . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 109.565 -0.531 . . . . 5.32 109.565 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -76.15 53.18 0.78 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.871 0.693 . . . . 4.42 112.871 -172.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -144.14 133.52 23.25 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.508 -0.923 . . . . 3.38 108.508 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -114.58 157.77 22.59 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.066 0.46 . . . . 2.64 111.735 -167.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -141.34 163.09 33.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.694 -0.685 . . . . 1.18 110.906 175.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.503 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.5 pt20 -106.94 166.38 11.2 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.616 -0.72 . . . . 1.22 109.196 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.503 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 50.5 Cg_exo -39.21 -44.13 2.69 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.058 2.505 . . . . 0.68 113.167 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -102.43 100.46 10.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.472 -0.566 . . . . 1.32 109.472 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 m -163.5 175.94 10.23 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.647 -0.706 . . . . 0.72 109.147 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.12 114.46 28.73 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.494 0.664 . . . . 1.9 111.113 -177.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.655 HG13 HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -104.1 145.89 12.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.013 -0.994 . . . . 0.56 109.049 175.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.571 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -113.37 166.92 11.01 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.668 -0.413 . . . . 1.99 110.781 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.731 HD11 ' HD3' ' A' ' 45' ' ' ARG . 64.3 mt -50.93 -46.73 60.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.826 0.676 . . . . 1.79 112.826 -175.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.492 ' HG3' ' OD2' ' A' ' 12' ' ' ASP . 25.9 mttp -60.25 -43.73 95.86 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.766 -0.827 . . . . 2.88 108.766 -177.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.91 -55.55 33.51 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.71 110.277 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.61 HG23 ' CE1' ' A' ' 53' ' ' HIS . 1.3 mt -53.25 -39.87 36.61 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.433 -0.349 . . . . 0.3 111.556 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 14' ' ' LYS . 74.3 mtm -60.15 -34.61 73.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.313 . . . . 1.81 110.957 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.14 61.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.259 0.552 . . . . 0.69 110.578 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -66.53 -25.34 66.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.075 -0.966 . . . . 1.34 111.729 -177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.645 HG21 HG12 ' A' ' 27' ' ' ILE . 38.8 p -99.76 -50.44 4.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.204 0.526 . . . . 1.21 111.002 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.98 9.78 60.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.412 -0.813 . . . . 0.49 111.466 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HE1' HD21 ' A' ' 65' ' ' ASN . 99.2 m-85 -133.21 -175.02 3.66 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.853 0.358 . . . . 0.71 111.717 -173.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.77 164.42 42.98 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.739 -0.664 . . . . 0.36 113.052 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 27' ' ' ILE . 37.2 pttt -47.99 -43.11 29.43 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.651 0.78 . . . . 2.23 112.969 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.5 t -59.08 -42.56 90.69 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.653 0.263 . . . . 0.49 111.285 -176.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.686 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 6.1 t80 -60.96 -43.0 99.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.44 110.109 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.645 HG12 HG21 ' A' ' 20' ' ' THR . 65.5 mt -58.38 -61.16 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.553 -0.749 . . . . 0.2 111.359 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -56.57 -42.46 78.68 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.232 -0.44 . . . . 0.57 111.128 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -66.85 -51.44 55.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.18 0.514 . . . . 0.64 111.101 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.686 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -64.65 -39.36 93.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.68 -0.691 . . . . 1.06 111.748 -174.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -74.28 -39.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.669 -0.241 . . . . 0.27 111.078 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.902 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 88.0 mttt -57.52 -42.73 83.4 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.198 -0.601 . . . . 1.86 109.738 172.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.7 t -77.5 -4.75 47.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.071 -0.968 . . . . 1.11 110.696 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.58 -60.32 4.06 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.806 -0.918 . . . . 0.56 110.806 176.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -168.72 29.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.95 110.28 174.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 81.7 mt 64.51 115.95 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 115.678 -0.692 . . . . 1.0 110.588 -175.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.902 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 24.5 Cg_exo -62.69 133.22 41.16 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.627 2.218 . . . . 0.44 113.652 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 51' ' ' ARG . 11.4 mptt -93.94 -4.53 49.62 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.335 -0.848 . . . . 1.01 109.007 171.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.727 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -43.06 153.75 0.08 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.099 -0.955 . . . . 0.37 112.075 172.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.483 ' HE2' HD11 ' A' ' 49' ' ' LEU . 4.1 mptp? -103.37 80.66 1.84 Allowed 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.662 0.744 . . . . 1.77 109.444 -177.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -95.42 81.83 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 CA-C-N 114.665 -1.152 . . . . 1.47 109.019 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' A' ' 43' ' ' HIS . 7.7 tp -102.04 -20.5 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.726 -1.125 . . . . 1.96 110.044 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.68 ' HD2' HG23 ' A' ' 42' ' ' ILE . 53.6 m-70 -123.08 48.63 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 3.26 110.659 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.44 -29.95 1.69 Allowed Glycine 0 CA--C 1.522 0.505 0 CA-C-N 115.866 -0.607 . . . . 1.44 113.817 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.731 ' HD3' HD11 ' A' ' 13' ' ' LEU . 95.1 mtt180 -144.87 -72.94 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.087 0.444 . . . . 5.04 110.019 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 59.36 -99.29 0.09 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.794 0.664 . . . . 0.74 112.794 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -142.84 150.06 39.4 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 122.247 -0.283 . . . . 3.15 111.041 -175.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.727 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.1 t-105 -113.53 143.75 44.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.105 -0.498 . . . . 0.4 110.17 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 24.6 mt -89.95 134.52 34.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.995 0.426 . . . . 1.33 109.894 175.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 47.7 t80 -67.34 -26.84 66.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.305 -0.407 . . . . 0.65 111.409 -175.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.53 ' HD2' ' HD3' ' A' ' 38' ' ' LYS . 13.8 ptp180 -49.69 -43.39 47.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.887 0.375 . . . . 1.03 111.052 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.488 ' CG ' ' HA ' ' A' ' 37' ' ' PRO . 14.9 m-20 -62.54 -35.62 80.03 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.298 0.571 . . . . 0.79 110.024 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.843 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 11.6 m170 -64.73 -45.88 84.65 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.303 -0.862 . . . . 0.28 109.314 175.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.05 -44.41 82.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.588 -0.733 . . . . 1.33 110.39 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.533 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 7.3 mm-40 -69.51 -42.33 74.86 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.402 -0.363 . . . . 1.34 111.26 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.843 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.59 -51.95 60.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.708 -0.397 . . . . 0.51 110.569 176.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 10.3 mmmm -55.53 -29.36 58.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.032 0.444 . . . . 1.57 110.186 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 33.0 t30 -63.02 -46.36 87.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.231 -0.895 . . . . 0.92 112.034 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.669 ' HD3' ' O ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -85.39 -16.13 40.85 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.775 -0.77 . . . . 1.27 110.402 -174.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.948 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 20.6 mt -81.88 -29.14 32.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.991 0.424 . . . . 0.81 110.016 169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' LYS . 24.3 tp -63.12 -41.75 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.473 -0.785 . . . . 1.5 110.844 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.2 p -74.51 -9.36 58.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.869 -0.605 . . . . 1.84 111.022 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -98.26 -81.49 0.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.416 -0.357 . . . . 6.09 110.702 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -171.22 29.89 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.534 -0.303 . . . . 3.75 111.636 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.948 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 48.3 t-20 -140.15 94.43 2.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 4.5 110.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.022 -1.432 . . . . 6.88 111.278 177.488 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.172 0.51 . . . . 5.32 109.83 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -97.22 -16.16 20.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.868 -0.606 . . . . 4.42 110.6 -173.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -119.7 131.28 55.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 3.38 110.859 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.59 166.26 10.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.668 -0.493 . . . . 2.64 109.668 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.739 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -145.33 167.86 21.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.408 0.623 . . . . 1.18 112.049 -177.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.564 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.0 pt20 -102.86 166.63 11.57 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.019 -0.992 . . . . 1.22 108.805 175.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.564 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.1 Cg_exo -38.24 -41.27 1.35 Allowed 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.354 2.703 . . . . 0.68 113.634 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -102.22 103.9 14.43 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.072 -0.651 . . . . 1.32 110.018 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 t -173.31 174.81 3.25 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.455 -0.793 . . . . 0.72 109.026 -177.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.647 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.6 pt? -105.71 116.86 32.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.523 0.678 . . . . 1.9 111.855 -173.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.739 HG12 HD21 ' A' ' 5' ' ' LEU . 6.1 m -107.09 165.82 4.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.408 -0.814 . . . . 0.56 108.996 172.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -129.41 168.08 16.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.957 -0.386 . . . . 1.99 109.957 177.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.1 mt -47.96 -50.05 28.5 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.619 0.6 . . . . 1.79 112.619 -177.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -62.57 -35.88 80.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.51 0.672 . . . . 2.88 109.759 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -64.48 -47.95 77.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.229 -0.896 . . . . 0.71 110.835 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.69 HG12 ' HE1' ' A' ' 53' ' ' HIS . 9.1 mt -54.96 -35.02 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.026 0.441 . . . . 0.3 110.876 176.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 82.5 mtp -62.56 -39.46 93.72 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 116.251 -0.431 . . . . 1.81 110.298 174.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.83 -31.93 70.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.146 0.498 . . . . 0.69 110.705 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.51 -49.06 79.05 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.274 -0.876 . . . . 1.34 110.095 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.8 p -114.22 -66.37 1.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.062 -0.517 . . . . 1.21 111.858 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 134.33 18.37 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.647 -0.706 . . . . 0.49 112.12 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -119.27 -176.7 3.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.634 0.254 . . . . 0.71 110.968 -174.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -96.73 171.5 27.58 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.033 -0.603 . . . . 0.36 113.215 -176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.3 mtmm -45.78 -48.02 15.54 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.772 0.829 . . . . 2.23 112.681 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.8 t -55.75 -42.64 75.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.49 111.373 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.467 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 10.6 t80 -61.64 -43.98 97.84 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.096 0.474 . . . . 0.44 109.982 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.592 HD12 ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt -59.65 -63.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.36 -0.836 . . . . 0.2 111.462 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -57.39 -38.69 74.67 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.447 -0.342 . . . . 0.57 111.065 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.72 -55.5 14.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.889 0.376 . . . . 0.64 111.236 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.87 -44.02 94.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.561 . . . . 1.06 111.672 -174.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.478 HD13 ' O ' ' A' ' 27' ' ' ILE . 1.8 mp -69.44 -49.83 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.27 111.26 -175.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.43 -41.67 90.09 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.013 0.435 . . . . 1.86 111.245 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -68.71 -23.07 64.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.789 -0.641 . . . . 1.11 110.934 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.89 -72.73 0.9 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.774 -0.727 . . . . 0.56 112.001 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.75 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 19.8 t70 -160.97 74.9 0.51 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.239 -0.184 . . . . 0.95 110.934 -178.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.6 mt 27.39 92.23 0.05 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.75 1.281 . . . . 1.0 113.83 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.45 132.26 47.75 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.985 2.457 . . . . 0.44 113.453 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.706 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 10.0 mptt -90.76 -4.88 56.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.442 -0.799 . . . . 1.01 109.344 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.946 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -46.59 150.28 0.7 Allowed 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.258 -0.883 . . . . 0.37 111.584 171.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 13.7 mptt -103.22 82.56 2.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.877 -0.786 . . . . 1.77 108.877 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.453 HG13 ' HA ' ' A' ' 45' ' ' ARG . 45.5 t -98.71 81.98 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.386 -0.825 . . . . 1.47 109.943 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -107.31 -25.66 3.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.394 0.616 . . . . 1.96 110.214 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -99.61 38.84 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.756 -0.656 . . . . 3.26 110.233 -177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.24 -30.46 1.62 Allowed Glycine 0 CA--C 1.517 0.177 0 CA-C-N 116.062 -0.517 . . . . 1.44 112.464 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HA ' HG13 ' A' ' 41' ' ' VAL . 18.9 ptt180 -147.83 -45.71 0.16 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.307 -0.627 . . . . 5.04 109.307 170.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . 51.58 -95.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 123.998 0.811 . . . . 0.74 111.296 -178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -146.05 133.64 20.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.374 -0.602 . . . . 3.15 109.374 173.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.738 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.4 t-105 -101.99 141.92 34.08 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.759 -0.83 . . . . 0.4 108.759 -179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.946 HD13 ' HA ' ' A' ' 39' ' ' ALA . 9.2 mp -91.06 140.54 29.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.512 0.673 . . . . 1.33 110.594 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 53.6 t80 -69.35 -28.11 65.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.342 -0.844 . . . . 0.65 110.779 -175.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 12.7 ptp180 -52.05 -38.06 55.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 1.03 111.303 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -69.38 -29.32 67.05 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.561 0.696 . . . . 0.79 109.978 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.895 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.0 m170 -72.33 -37.01 69.0 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.213 -0.903 . . . . 0.28 109.668 177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.7 t -56.68 -38.67 72.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.009 -0.541 . . . . 1.33 109.618 178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.75 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 67.2 mm-40 -67.55 -52.88 33.44 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.937 -0.574 . . . . 1.34 110.965 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.895 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -63.28 -48.02 79.87 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.671 -0.411 . . . . 0.51 110.595 -177.034 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -57.43 -33.35 67.82 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 116.379 -0.373 . . . . 1.57 110.902 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.701 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 12.2 t30 -54.08 -45.32 71.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.445 -0.798 . . . . 0.92 111.222 -177.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 56' ' ' PHE . 33.4 pttt -84.6 -36.69 21.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.944 0.402 . . . . 1.27 110.592 -173.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.82 -42.33 90.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.8 -0.636 . . . . 0.81 111.296 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 40.2 tp -65.4 -36.01 82.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 1.5 110.527 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -78.5 -7.35 57.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.749 -0.659 . . . . 1.84 110.822 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 51.91 37.51 21.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.013 -0.994 . . . . 6.09 112.069 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -98.87 36.0 1.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.484 0.659 . . . . 3.75 109.828 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.8 72.15 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.416 -0.811 . . . . 4.5 110.398 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.76 -1.022 . . . . 6.88 111.833 179.183 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 tmm? . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.028 -0.36 . . . . 5.32 110.028 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.05 137.67 58.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.488 . . . . 4.42 111.303 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -104.17 104.73 14.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.051 -1.092 . . . . 3.38 108.051 174.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -101.08 103.66 14.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.103 0.478 . . . . 2.64 110.279 -171.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.579 HD21 HG12 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -126.12 167.25 15.64 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.259 -0.882 . . . . 1.18 110.864 -179.091 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.64 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 4.4 pt20 -126.14 166.29 22.46 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.657 -0.868 . . . . 1.22 108.657 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 21.7 Cg_exo -25.96 -50.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.362 1.271 0 C-N-CA 125.016 3.811 . . . . 0.68 115.198 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -100.78 102.73 13.88 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.907 -0.717 . . . . 1.32 109.524 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -176.8 169.84 2.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.122 -0.944 . . . . 0.72 108.461 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.46 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -104.16 123.5 47.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.664 0.745 . . . . 1.9 111.609 -172.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.697 HG21 ' CE1' ' A' ' 53' ' ' HIS . 19.9 m -104.47 166.19 3.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.386 -1.279 . . . . 0.56 110.041 176.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.584 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.3 t70 -111.99 163.73 13.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.138 -0.483 . . . . 1.99 110.693 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 tp -55.11 -50.95 67.92 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.795 0.331 . . . . 1.79 111.451 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -63.11 -32.9 74.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.441 0.639 . . . . 2.88 109.562 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -63.85 -47.36 81.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.9 -1.045 . . . . 0.71 110.472 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 12' ' ' ASP . 9.1 mt -51.95 -44.26 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 121.013 0.435 . . . . 0.3 110.494 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 65.0 mtt -61.19 -31.22 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.652 -0.703 . . . . 1.81 110.615 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.19 66.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.69 110.67 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -65.3 -30.85 71.75 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.982 -0.554 . . . . 1.34 111.351 178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.509 HG22 ' CZ ' ' A' ' 56' ' ' PHE . 41.7 p -99.38 -48.61 4.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.194 -0.457 . . . . 1.21 112.183 -172.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.22 11.63 72.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.856 -0.897 . . . . 0.49 110.856 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.84 -175.53 3.5 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.932 0.396 . . . . 0.71 111.266 -175.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.0 172.5 30.93 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 121.036 -0.602 . . . . 0.36 113.021 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' HD12 ' A' ' 27' ' ' ILE . 55.3 pttt -47.69 -42.16 24.29 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.08 0.77 . . . . 2.23 113.08 -177.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.1 t -57.61 -46.55 83.94 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.64 0.257 . . . . 0.49 111.676 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.658 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 14.4 t80 -60.83 -42.4 97.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.331 -0.395 . . . . 0.44 109.971 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 24' ' ' LYS . 84.9 mt -58.56 -65.01 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.652 -0.704 . . . . 0.2 111.393 -177.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 7.3 m-85 -58.33 -39.54 79.73 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.297 -0.41 . . . . 0.57 111.304 -173.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.4 -53.55 16.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.914 -0.314 . . . . 0.64 111.242 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.658 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.9 OUTLIER -65.2 -40.88 94.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.402 . . . . 1.06 111.983 -175.352 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.685 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.8 mp -67.61 -38.82 81.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 121.001 -0.279 . . . . 0.27 110.322 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 28' ' ' TYR . 59.3 mttp -57.95 -45.56 86.44 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.224 0.535 . . . . 1.86 110.35 170.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 41.1 t -65.56 -28.39 69.12 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.414 -0.812 . . . . 1.11 111.196 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.75 -71.83 0.73 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.01 -0.614 . . . . 0.56 112.349 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -160.84 23.35 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.901 0.381 . . . . 0.95 110.836 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 68.3 mt 66.85 126.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.999 -176.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.685 ' HG3' HG22 ' A' ' 31' ' ' ILE . 34.2 Cg_exo -60.15 129.09 28.65 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.679 2.252 . . . . 0.44 113.041 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 2.1 mptp? -90.15 -5.84 56.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.712 -0.847 . . . . 1.01 108.712 174.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . . . -39.2 160.08 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.521 -1.218 . . . . 0.37 113.746 175.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE3' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -102.45 83.03 2.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.581 -0.736 . . . . 1.77 109.104 -175.439 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.5 t -97.04 102.64 13.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.726 -1.124 . . . . 1.47 110.306 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 tp -107.71 -21.44 5.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.986 0.422 . . . . 1.96 110.779 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -134.0 50.27 2.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.621 -0.263 . . . . 3.26 110.942 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.3 -27.6 2.77 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.948 -0.644 . . . . 1.44 113.066 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -139.73 -76.85 0.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.737 0.303 . . . . 5.04 110.815 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 58.37 -103.15 0.16 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.654 -0.703 . . . . 0.74 111.782 -175.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -141.19 146.82 37.42 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.842 0.353 . . . . 3.15 110.206 -175.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.672 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -109.13 157.33 18.85 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.989 -0.55 . . . . 0.4 109.996 -174.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.78 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 23.8 mt -95.69 145.58 25.17 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.933 0.397 . . . . 1.33 110.371 176.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -65.89 -39.64 90.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.444 . . . . 0.65 110.572 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 9.0 ptp180 -48.77 -38.16 21.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.03 112.021 176.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.445 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 58.0 m-20 -60.38 -30.97 69.92 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.399 0.618 . . . . 0.79 110.469 178.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.888 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 26.4 m170 -77.07 -37.73 53.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.535 -0.757 . . . . 0.28 109.06 176.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 61.2 m -58.3 -46.12 86.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.657 -0.701 . . . . 1.33 110.146 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 58.0 mm-40 -66.16 -44.22 84.75 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.259 -0.428 . . . . 1.34 111.859 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.888 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -63.56 -47.83 79.93 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.084 -0.646 . . . . 0.51 110.273 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 57' ' ' LYS . 6.3 mmpt? -58.95 -33.74 70.97 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.57 110.874 175.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.567 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 8.0 t30 -61.13 -41.51 96.84 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.053 -0.976 . . . . 0.92 111.676 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.19 -37.11 66.61 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.26 0.552 . . . . 1.27 109.581 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.501 ' O ' ' HA ' ' A' ' 64' ' ' ALA . 36.7 mt -69.46 -16.9 63.56 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.599 -0.728 . . . . 0.81 110.595 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.0 tp -82.91 -46.35 13.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.609 -0.723 . . . . 1.5 110.761 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t -74.33 -50.11 20.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 1.84 110.575 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.6 mtt180 -80.49 -21.5 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.344 -0.389 . . . . 6.09 111.086 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HA ' ' O ' ' A' ' 60' ' ' LEU . . . 46.72 65.53 1.19 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.527 0.517 . . . . 3.75 111.801 175.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -112.0 72.89 0.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.71 0.767 . . . . 4.5 110.856 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-N 115.355 -0.839 . . . . 6.88 111.118 179.22 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 120.778 0.323 . . . . 5.32 110.527 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -150.18 136.76 19.06 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.884 -0.413 . . . . 4.42 109.884 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -126.86 109.67 12.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.122 0.487 . . . . 3.38 110.19 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.07 118.78 37.56 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.497 -0.774 . . . . 2.64 108.958 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.67 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.8 OUTLIER -132.39 165.05 25.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.681 0.753 . . . . 1.18 111.845 -172.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.602 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.4 pt20 -104.47 166.57 11.32 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.123 -1.399 . . . . 1.22 109.107 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 29.1 Cg_exo -34.63 -37.66 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 124.162 3.242 . . . . 0.68 114.97 -177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.54 103.32 13.65 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.105 -0.638 . . . . 1.32 110.305 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.67 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 15.5 t 177.81 175.29 0.49 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.224 -1.028 . . . . 0.72 108.224 178.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -104.42 115.81 31.03 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.628 0.728 . . . . 1.9 111.678 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 48' ' ' TRP . 32.3 m -105.1 165.07 3.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.166 -0.925 . . . . 0.56 109.155 173.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.714 ' O ' HG13 ' A' ' 16' ' ' ILE . 30.8 t70 -115.57 164.06 14.86 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.966 -0.293 . . . . 1.99 111.318 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.11 -50.14 71.9 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.087 0.47 . . . . 1.79 110.725 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -62.62 -34.58 77.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.77 . . . . 2.88 109.096 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.436 ' HB3' ' H ' ' A' ' 12' ' ' ASP . 34.1 t80 -63.9 -43.48 95.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.866 -1.061 . . . . 0.71 110.758 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.718 HG12 ' CE1' ' A' ' 53' ' ' HIS . 17.6 mt -54.46 -38.15 40.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 121.219 0.533 . . . . 0.3 110.698 174.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 73.3 mtp -63.81 -38.89 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.966 -0.561 . . . . 1.81 110.521 175.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.3 -28.62 65.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.177 0.513 . . . . 0.69 110.659 174.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 10.1 t70 -62.76 -39.74 95.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.377 -0.829 . . . . 1.34 110.255 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -127.27 -75.22 0.58 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.646 0.736 . . . . 1.21 111.363 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.28 27.22 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 114.995 -1.002 . . . . 0.49 111.859 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -118.59 177.27 4.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.71 0.29 . . . . 0.71 110.503 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.62 164.65 21.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.026 -0.607 . . . . 0.36 113.103 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.596 ' HA ' HD12 ' A' ' 27' ' ' ILE . 15.4 pttp -42.94 -42.82 3.87 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.324 1.231 . . . . 2.23 114.324 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -57.75 -45.52 85.77 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.974 -0.29 . . . . 0.49 110.988 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.493 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 8.8 t80 -61.66 -44.38 97.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.864 0.364 . . . . 0.44 110.084 176.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 24' ' ' LYS . 63.3 mt -55.85 -63.23 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.228 -176.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -57.01 -43.26 81.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.194 -0.457 . . . . 0.57 111.212 -174.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -65.4 -50.49 65.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.125 0.488 . . . . 0.64 111.194 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.0 -44.49 84.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.964 -0.562 . . . . 1.06 112.062 -175.082 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.878 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -71.06 -38.34 71.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.635 -0.257 . . . . 0.27 111.281 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 67.3 mttm -58.11 -43.87 87.41 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.498 0.665 . . . . 1.86 109.818 173.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -62.54 -28.22 69.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.776 -1.102 . . . . 1.11 111.091 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.0 -75.44 0.28 Allowed Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.69 -0.564 . . . . 0.56 111.69 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -173.61 70.85 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.257 0.465 . . . . 0.95 112.257 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt 49.39 90.66 0.08 OUTLIER Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 115.676 -0.693 . . . . 1.0 112.307 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.878 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.1 Cg_exo -45.38 120.41 3.17 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 123.043 2.495 . . . . 0.44 113.182 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.2 mptp? -82.85 -6.48 59.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.413 -0.588 . . . . 1.01 109.413 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.845 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.3 154.29 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.838 -1.073 . . . . 0.37 111.909 171.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -106.66 84.25 1.98 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.491 0.663 . . . . 1.77 109.433 -177.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.9 t -96.84 96.84 5.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.252 -0.886 . . . . 1.47 110.304 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 tp -104.47 -22.44 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.185 0.517 . . . . 1.96 110.854 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' ARG . 13.2 t-80 -112.97 31.3 6.51 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.289 0.566 . . . . 3.26 110.483 -175.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.78 -30.79 0.62 Allowed Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.916 -0.584 . . . . 1.44 112.335 -175.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.9 mtm180 -147.59 123.33 10.55 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.164 -1.421 . . . . 5.04 107.164 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.08 -96.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.189 -0.604 . . . . 0.74 112.048 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.469 ' HD2' HD12 ' A' ' 10' ' ' LEU . 31.0 mtm180 -137.1 137.64 39.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.647 -0.501 . . . . 3.15 109.647 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.9 OUTLIER -106.97 154.33 21.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.084 -0.507 . . . . 0.4 110.06 -174.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.845 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.5 mp -96.52 146.16 25.05 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.821 0.82 . . . . 1.33 110.938 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 40.0 t80 -66.55 -38.48 87.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.553 -1.203 . . . . 0.65 110.54 -178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.447 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 13.5 ptp180 -53.07 -39.48 63.33 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.081 -0.509 . . . . 1.03 111.589 176.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -62.48 -36.53 82.78 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.367 0.603 . . . . 0.79 110.164 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.903 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 20.7 m170 -66.82 -39.14 87.57 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.491 -0.777 . . . . 0.28 109.342 175.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ASN . 42.6 t -55.93 -42.94 76.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.688 -0.687 . . . . 1.33 109.856 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 34.4 mm-40 -66.44 -49.39 66.87 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.052 0.454 . . . . 1.34 111.091 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.903 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.73 -46.92 77.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.51 111.617 -175.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' A' ' 57' ' ' LYS . 10.1 mmmm -58.51 -37.7 76.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.453 0.644 . . . . 1.57 110.317 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 26.7 t30 -57.93 -54.05 51.32 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.696 -1.138 . . . . 0.92 111.431 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HG3' HD21 ' A' ' 65' ' ' ASN . 3.4 pttp -70.31 -31.85 69.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 1.27 110.7 -175.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.424 HD11 ' CD ' ' A' ' 30' ' ' ARG . 34.4 mt -74.86 -26.27 59.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.81 111.478 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.16 -58.08 10.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.419 0.628 . . . . 1.5 109.563 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.2 t -77.12 -35.83 55.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.683 -1.144 . . . . 1.84 112.0 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -132.02 109.3 9.93 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 120.881 0.372 . . . . 6.09 110.14 -168.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.78 68.31 0.27 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.193 0.52 . . . . 3.75 110.966 174.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.638 HD21 ' HG3' ' A' ' 59' ' ' LYS . 8.4 p30 -88.23 3.99 47.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.81 -0.632 . . . . 4.5 111.819 -175.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.788 0 CA-C-O 118.587 -1.118 . . . . 6.88 111.598 -177.535 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.479 0.18 . . . . 5.32 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -52.48 -47.17 66.7 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.802 0.667 . . . . 4.42 112.802 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -136.13 131.8 35.22 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.048 -0.408 . . . . 3.38 110.925 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -104.99 139.39 39.76 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.115 -0.698 . . . . 2.64 109.115 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.15 165.18 32.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.525 0.679 . . . . 1.18 112.494 -176.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.581 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.6 pt20 -105.12 165.99 12.22 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 114.748 -1.115 . . . . 1.22 109.333 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 31.1 Cg_exo -32.85 -49.2 0.37 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 124.087 3.191 . . . . 0.68 114.539 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -101.81 103.97 14.71 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.011 -0.676 . . . . 1.32 109.527 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -165.87 171.08 13.11 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.009 -0.996 . . . . 0.72 108.882 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -104.08 107.57 18.52 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.314 0.578 . . . . 1.9 111.958 -173.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.612 HG21 ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -103.4 166.1 2.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.404 -0.816 . . . . 0.56 109.856 171.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.574 ' O ' HG13 ' A' ' 16' ' ' ILE . 19.4 t70 -118.33 165.91 13.27 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.329 -0.396 . . . . 1.99 110.172 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.5 tp -54.54 -44.76 73.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 1.79 110.663 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -60.78 -37.07 80.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 2.88 109.607 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CB ' ' H ' ' A' ' 12' ' ' ASP . 6.6 t80 -63.85 -46.09 86.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.029 -0.987 . . . . 0.71 110.649 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 12' ' ' ASP . 4.0 mt -53.24 -40.62 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.112 0.482 . . . . 0.3 111.077 176.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 88.9 mtp -61.76 -37.3 83.76 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.922 -0.581 . . . . 1.81 110.247 176.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.67 -31.25 66.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.977 -0.556 . . . . 0.69 111.345 175.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -61.12 -45.44 94.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.433 -0.803 . . . . 1.34 110.282 -176.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.0 p -116.15 -56.42 2.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.841 -0.618 . . . . 1.21 111.737 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 118.18 22.86 3.7 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.49 111.857 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.412 ' HD1' ' CE1' ' A' ' 26' ' ' PHE . 23.5 m-85 -115.78 -177.38 3.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.71 111.466 -174.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.31 156.44 28.19 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.882 -0.599 . . . . 0.36 113.08 -177.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 27' ' ' ILE . 22.8 pttm -50.59 -35.7 31.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.891 0.7 . . . . 2.23 112.891 -178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.3 t -58.86 -43.73 90.87 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.01 0.433 . . . . 0.49 110.652 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 4.9 t80 -59.98 -43.16 95.3 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.536 -0.757 . . . . 0.44 110.151 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.631 HD12 ' HA ' ' A' ' 24' ' ' LYS . 62.6 mt -59.32 -64.64 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.869 . . . . 0.2 111.425 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.56 ' OH ' ' HD3' ' A' ' 45' ' ' ARG . 56.1 m-85 -61.32 -34.77 75.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.159 -0.473 . . . . 0.57 111.887 -171.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.87 -54.08 36.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.295 0.569 . . . . 0.64 110.028 174.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.628 ' HG3' ' HE2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.57 -47.4 78.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.291 -0.868 . . . . 1.06 111.821 -173.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.838 HG22 ' HG3' ' A' ' 37' ' ' PRO . 2.2 mp -74.01 -40.5 52.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.235 -0.439 . . . . 0.27 111.68 -173.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -59.07 -40.07 84.05 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.061 0.458 . . . . 1.86 111.146 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.0 t -82.46 -9.02 59.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.827 -0.624 . . . . 1.11 110.613 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.94 -66.11 2.12 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 121.109 -0.567 . . . . 0.56 113.006 -175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.563 ' HB2' ' HG3' ' A' ' 55' ' ' GLU . 33.8 t70 -143.77 14.97 1.75 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.969 0.414 . . . . 0.95 111.967 -173.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.1 mt 57.15 84.77 0.2 Allowed Pre-proline 0 N--CA 1.467 0.412 0 CA-C-N 115.912 -0.585 . . . . 1.0 109.893 -173.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.838 ' HG3' HG22 ' A' ' 31' ' ' ILE . 86.6 Cg_exo -41.13 119.96 1.01 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.989 3.126 . . . . 0.44 115.057 -167.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.58 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -86.95 -2.27 58.48 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.038 -0.983 . . . . 1.01 109.127 175.432 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -44.57 156.43 0.08 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.499 -1.228 . . . . 0.37 111.715 170.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.534 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 3.3 mptp? -101.7 78.66 1.85 Allowed 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 107.867 -1.16 . . . . 1.77 107.867 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 45' ' ' ARG . 3.3 p -118.74 99.47 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-N 113.681 -1.6 . . . . 1.47 110.418 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -136.35 -15.44 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.07 0.462 . . . . 1.96 110.387 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -101.51 21.66 13.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.454 . . . . 3.26 111.554 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.95 52.07 1.55 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.574 -1.298 . . . . 1.44 112.786 177.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HA ' HG23 ' A' ' 41' ' ' VAL . 58.7 mtt180 70.53 92.33 0.09 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.011 0.524 . . . . 5.04 110.77 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.85 -81.56 0.64 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 0.74 112.27 -174.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -120.56 138.63 53.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.846 -0.427 . . . . 3.15 109.846 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.769 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -116.62 146.29 42.8 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.954 0.407 . . . . 0.4 110.786 -176.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . 4.0 mp -88.44 140.05 29.86 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.348 0.594 . . . . 1.33 110.176 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 53' ' ' HIS . 41.9 t80 -67.59 -27.71 67.15 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.515 -0.766 . . . . 0.65 110.693 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.667 ' HG2' ' HB3' ' A' ' 49' ' ' LEU . 10.2 ptp180 -53.33 -42.31 66.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.03 111.18 175.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 37' ' ' PRO . 21.7 m-20 -61.01 -33.43 73.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.776 0.798 . . . . 0.79 109.423 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.912 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 17.1 m170 -71.42 -38.0 71.43 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.059 -0.973 . . . . 0.28 110.009 176.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 71.6 m -54.31 -49.45 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.385 0.428 . . . . 1.33 110.337 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.563 ' HG3' ' HB2' ' A' ' 35' ' ' ASP . 53.4 mm-40 -68.85 -41.09 78.96 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.56 0.578 . . . . 1.34 112.56 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.912 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -65.6 -43.38 89.83 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.453 -0.899 . . . . 0.51 110.505 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -59.78 -26.96 66.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.076 0.465 . . . . 1.57 110.573 172.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.9 t30 -77.26 -53.29 7.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.197 -0.91 . . . . 0.92 111.378 -176.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' HD3' ' HA ' ' A' ' 56' ' ' PHE . 15.2 ptmt -58.54 -36.7 74.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.438 . . . . 1.27 110.472 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.729 HD23 ' H ' ' A' ' 65' ' ' ASN . 21.4 mt -73.3 -26.16 60.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.92 -0.582 . . . . 0.81 111.798 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.5 tp -82.66 -38.89 22.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 1.5 110.912 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -90.17 -51.86 5.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.093 -0.503 . . . . 1.84 111.93 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.1 mtm180 -90.62 -38.0 13.41 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.333 -0.23 . . . . 6.09 110.983 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 68.38 116.03 0.04 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 O-C-N 124.101 0.876 . . . . 3.75 111.267 -176.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.729 ' H ' HD23 ' A' ' 60' ' ' LEU . 0.7 OUTLIER -110.3 152.12 26.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.047 -0.723 . . . . 4.5 109.047 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.531 -1.149 . . . . 6.88 111.95 179.534 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.647 0.26 . . . . 5.32 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -91.27 135.35 33.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.689 0.281 . . . . 4.42 110.626 -177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -103.98 111.83 24.56 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.406 -0.59 . . . . 3.38 109.406 177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -103.54 147.6 26.98 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.927 -0.579 . . . . 2.64 110.544 -174.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 11' ' ' VAL . 0.3 OUTLIER -159.35 168.75 25.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.332 0.586 . . . . 1.18 111.897 -170.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.612 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 20.4 pt20 -104.22 165.26 13.69 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.385 -0.825 . . . . 1.22 109.454 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 5.7 Cg_exo -29.92 -47.97 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 124.855 3.704 . . . . 0.68 115.477 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -101.73 104.09 14.87 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.29 -0.564 . . . . 1.32 109.896 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -173.91 -179.83 1.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.165 -0.925 . . . . 0.72 108.584 -178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.452 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.9 OUTLIER -109.07 117.59 34.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.498 0.666 . . . . 1.9 111.699 -173.1 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.694 HG12 HD21 ' A' ' 5' ' ' LEU . 30.0 m -105.09 165.93 3.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.051 -0.977 . . . . 0.56 109.726 174.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.519 ' O ' HG13 ' A' ' 16' ' ' ILE . 13.9 t70 -107.91 164.07 12.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.631 -0.259 . . . . 1.99 110.335 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.39 -40.59 89.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.132 0.491 . . . . 1.79 110.486 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -62.58 -32.37 73.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.779 . . . . 2.88 109.128 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.489 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 33.6 t80 -63.58 -49.78 72.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.566 -1.197 . . . . 0.71 110.871 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.799 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.2 mt -51.65 -46.67 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.393 0.616 . . . . 0.3 110.779 176.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.0 mtp -61.39 -29.05 69.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.433 -0.803 . . . . 1.81 110.837 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.85 -48.5 45.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.252 -0.431 . . . . 0.69 111.521 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD1' ' HA ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -69.86 -25.12 63.57 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.935 -0.306 . . . . 1.34 111.389 -175.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.431 HG23 ' OD2' ' A' ' 19' ' ' ASP . 19.5 p -107.59 -76.67 0.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.091 0.472 . . . . 1.21 111.786 176.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 131.7 17.6 1.34 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.571 -0.74 . . . . 0.49 112.21 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 85.8 m-85 -123.26 178.05 5.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.71 110.893 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -94.75 171.74 30.58 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.36 113.798 -176.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' HD12 ' A' ' 27' ' ' ILE . 33.4 mtmm -43.36 -47.89 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.4 1.08 . . . . 2.23 113.094 -178.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -54.58 -46.22 73.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.348 -0.387 . . . . 0.49 111.536 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 5.5 t80 -59.96 -45.8 91.49 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.753 -0.462 . . . . 0.44 109.753 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 24' ' ' LYS . 73.3 mt -57.32 -61.05 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.298 -0.864 . . . . 0.2 111.55 -177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.503 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 3.8 m-85 -57.05 -38.06 72.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.42 -0.355 . . . . 0.57 110.984 -175.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -64.91 -51.45 61.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.64 110.728 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 26' ' ' PHE . 5.8 mmp_? -62.76 -49.4 75.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 1.06 111.535 -176.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.879 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -69.21 -37.93 77.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.305 -0.407 . . . . 0.27 111.933 -170.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 15.8 mtmm -62.05 -46.6 88.45 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.24 -0.584 . . . . 1.86 111.258 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.433 ' HB2' ' HE2' ' A' ' 59' ' ' LYS . 43.6 m -66.67 -22.51 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.837 0.351 . . . . 1.11 110.872 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.0 -64.94 3.4 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.41 -0.676 . . . . 0.56 111.41 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.566 ' HB3' ' HG3' ' A' ' 55' ' ' GLU . 49.8 t0 -175.39 73.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 110.249 -0.278 . . . . 0.95 110.249 176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.5 mt 25.58 91.51 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.852 0 O-C-N 125.125 1.515 . . . . 1.0 112.786 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.879 ' HG3' HG22 ' A' ' 31' ' ' ILE . 78.4 Cg_exo -41.78 124.08 2.54 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.894 3.063 . . . . 0.44 114.418 -168.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -83.82 -7.08 59.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.653 -0.869 . . . . 1.01 108.653 173.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.888 ' HA ' HD13 ' A' ' 49' ' ' LEU . . . -45.31 152.11 0.31 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 114.623 -1.171 . . . . 0.37 111.69 171.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 19.5 mmmt -101.1 82.2 2.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.647 -0.871 . . . . 1.77 108.647 -177.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.87 105.96 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.278 -0.874 . . . . 1.47 110.609 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.4 tp -108.34 -30.13 2.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.067 -0.515 . . . . 1.96 111.159 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.465 ' C ' ' H ' ' A' ' 45' ' ' ARG . 11.8 t-160 -123.71 51.61 1.5 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.229 -0.441 . . . . 3.26 110.411 -174.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.11 -31.28 0.78 Allowed Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.734 -0.666 . . . . 1.44 112.145 -177.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 43' ' ' HIS . 39.6 ptt180 -151.94 166.35 31.78 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.686 -1.227 . . . . 5.04 107.686 171.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' LYS . . . -177.45 -84.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.946 -0.39 . . . . 0.74 109.946 175.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -140.7 130.44 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.522 -0.547 . . . . 3.15 109.522 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.74 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 1.2 t-105 -103.52 147.74 26.81 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.367 -0.605 . . . . 0.4 109.367 -176.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.888 HD13 ' HA ' ' A' ' 39' ' ' ALA . 7.6 mp -92.18 146.4 23.75 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.534 0.683 . . . . 1.33 110.785 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -70.16 -36.68 74.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.089 -0.96 . . . . 0.65 110.708 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.517 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 10.2 ptp180 -49.93 -42.36 48.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 1.03 111.915 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 8.8 m-20 -63.49 -31.71 72.95 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.279 0.562 . . . . 0.79 109.953 -179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.889 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.5 m170 -69.55 -44.24 71.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.503 -0.771 . . . . 0.28 109.29 176.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 80.3 m -55.11 -45.97 75.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.358 . . . . 1.33 110.397 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 41.7 mm-40 -66.51 -48.48 69.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.996 -0.547 . . . . 1.34 111.196 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.889 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.16 -48.45 75.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.422 -0.354 . . . . 0.51 111.342 -178.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -54.7 -38.43 67.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.422 0.629 . . . . 1.57 109.543 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 20.0 t30 -57.31 -41.6 80.2 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.394 -1.275 . . . . 0.92 112.081 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 30' ' ' ARG . 4.3 pttp -79.43 -30.07 42.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 1.27 110.231 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.5 mt -76.21 -36.6 58.52 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.161 -0.472 . . . . 0.81 110.302 176.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.2 tp -60.24 -41.38 93.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.656 -0.702 . . . . 1.5 110.959 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.6 p -75.41 -12.99 60.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 1.84 111.142 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 23.3 mtp-105 -105.01 26.08 9.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 6.09 111.105 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 58.38 46.96 14.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 3.75 111.572 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -143.23 164.22 30.79 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.188 -0.671 . . . . 4.5 109.188 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.267 -1.296 . . . . 6.88 111.23 176.317 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.105 0.478 . . . . 5.32 110.489 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -69.66 125.06 25.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 4.42 111.123 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -158.57 119.05 3.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.818 -0.628 . . . . 3.38 109.918 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -102.07 162.26 13.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.324 -0.621 . . . . 2.64 109.324 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 9' ' ' SER . 0.6 OUTLIER -153.12 166.31 32.9 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.531 0.682 . . . . 1.18 111.809 -175.423 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 19.5 pt20 -103.99 166.83 10.96 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 114.542 -1.208 . . . . 1.22 109.302 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.579 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 52.9 Cg_exo -38.67 -39.25 1.15 Allowed 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.8 3.0 . . . . 0.68 113.998 -177.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -102.24 102.61 13.04 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.515 0.674 . . . . 1.32 110.342 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.584 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 22.6 t 179.28 175.28 0.69 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.808 -1.087 . . . . 0.72 108.34 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' ' 10' ' ' LEU . 2.7 pp -103.99 119.56 39.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.03 0.919 . . . . 1.9 111.744 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HB3' ' A' ' 48' ' ' TRP . 34.1 m -104.76 158.15 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.663 -1.153 . . . . 0.56 109.411 174.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.586 ' O ' HG13 ' A' ' 16' ' ' ILE . 14.3 t70 -104.72 165.52 11.01 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.269 -0.172 . . . . 1.99 110.852 -176.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 tp -59.89 -46.8 88.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.807 0.337 . . . . 1.79 110.914 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -62.49 -33.79 75.56 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.798 0.808 . . . . 2.88 109.395 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 48.4 t80 -60.64 -46.56 89.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.636 -1.165 . . . . 0.71 110.04 176.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.81 HG12 ' CE1' ' A' ' 53' ' ' HIS . 6.5 mt -54.23 -38.86 40.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.089 0.471 . . . . 0.3 111.228 175.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.27 -40.57 96.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.998 -0.547 . . . . 1.81 110.271 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.06 -29.87 65.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.143 0.497 . . . . 0.69 110.806 174.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.68 -33.74 76.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.412 -0.813 . . . . 1.34 110.319 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 p -127.24 -70.87 0.69 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.156 0.503 . . . . 1.21 111.344 178.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.0 12.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.519 -0.764 . . . . 0.49 112.685 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' HB2' ' CD1' ' A' ' 26' ' ' PHE . 92.1 m-85 -113.17 -176.24 2.85 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.477 -0.425 . . . . 0.71 111.031 -173.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.91 175.68 26.5 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 116.032 -0.531 . . . . 0.36 113.434 -177.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -46.23 -50.64 15.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.68 0.993 . . . . 2.23 113.68 -175.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 t -57.07 -43.03 81.68 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.693 0.282 . . . . 0.49 111.74 -174.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.574 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 5.3 t80 -59.88 -46.22 90.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.44 110.225 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.518 HD12 ' HA ' ' A' ' 24' ' ' LYS . 72.7 mt -57.08 -54.77 25.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.198 -0.91 . . . . 0.2 111.171 -177.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.44 ' N ' ' HD1' ' A' ' 28' ' ' TYR . 1.5 m-30 -59.07 -42.7 90.98 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.775 -0.648 . . . . 0.57 111.033 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -69.03 -52.73 25.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.282 0.563 . . . . 0.64 110.713 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD2' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -62.5 -37.78 87.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.337 -0.847 . . . . 1.06 111.391 -172.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.748 HG22 ' HG3' ' A' ' 37' ' ' PRO . 1.9 mp -81.56 -52.01 14.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 0.27 111.993 -176.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.699 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 33.8 mtmt -61.06 -39.2 88.95 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.871 0.367 . . . . 1.86 111.402 -176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -71.83 -23.17 61.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 1.11 110.481 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.33 -69.45 1.39 Allowed Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.998 -0.546 . . . . 0.56 112.707 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -148.33 53.93 1.02 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.117 -0.233 . . . . 0.95 110.963 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.1 mt 29.88 88.61 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.966 0 O-C-N 124.211 0.944 . . . . 1.0 113.015 170.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.748 ' HG3' HG22 ' A' ' 31' ' ' ILE . 85.6 Cg_exo -41.92 127.96 3.85 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 124.512 3.475 . . . . 0.44 115.102 -171.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.594 ' HB2' ' HD2' ' A' ' 51' ' ' ARG . 8.8 mptt -86.07 -8.28 58.01 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.906 -1.043 . . . . 1.01 109.096 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.788 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -46.9 160.69 0.08 Allowed 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 114.86 -1.064 . . . . 0.37 112.367 174.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.582 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 23.0 mmtp -105.62 83.24 1.91 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 108.653 -0.869 . . . . 1.77 108.653 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -99.55 119.93 48.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-N 114.79 -1.095 . . . . 1.47 110.941 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tp -116.54 -28.59 2.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.188 -0.46 . . . . 1.96 111.533 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' ARG . 88.7 m-70 -126.49 41.33 3.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.809 0.338 . . . . 3.26 110.608 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.74 -28.48 1.31 Allowed Glycine 0 C--O 1.226 -0.353 0 N-CA-C 111.293 -0.723 . . . . 1.44 111.293 -173.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 43' ' ' HIS . 3.4 ptm180 -144.56 157.62 44.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.071 -1.085 . . . . 5.04 108.071 173.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -179.8 -86.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.566 0.541 . . . . 0.74 110.114 176.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.582 ' HG3' ' HB2' ' A' ' 40' ' ' LYS . 27.1 ptt180 -136.24 118.29 15.38 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.551 -0.907 . . . . 3.15 108.551 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HA ' ' HB1' ' A' ' 39' ' ' ALA . 0.9 OUTLIER -105.83 144.06 33.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.032 -0.531 . . . . 0.4 109.974 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' ' 39' ' ' ALA . 26.7 mt -85.59 138.05 32.44 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.405 0.621 . . . . 1.33 110.055 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' A' ' 7' ' ' PRO . 56.6 t80 -63.36 -31.65 72.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.321 -0.854 . . . . 0.65 110.343 -178.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.594 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 11.9 ptp180 -51.23 -44.13 61.62 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.374 -0.376 . . . . 1.03 111.659 175.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.505 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 17.7 m-20 -62.94 -33.59 75.67 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.418 0.628 . . . . 0.79 110.03 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.835 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 15.1 m170 -69.38 -40.55 77.33 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.353 -0.839 . . . . 0.28 109.886 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ARG . 9.3 t -52.99 -50.37 64.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 1.33 110.635 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 30.5 mm-40 -70.56 -42.92 70.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.919 -0.582 . . . . 1.34 111.801 -176.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.835 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -63.63 -48.69 76.28 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 120.22 -0.592 . . . . 0.51 110.775 177.853 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 57' ' ' LYS . 12.1 mmmm -57.85 -32.41 67.62 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.032 0.444 . . . . 1.57 110.247 176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 21.0 t30 -60.16 -51.03 71.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.031 -0.986 . . . . 0.92 111.229 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HE2' ' HG3' ' A' ' 30' ' ' ARG . 32.0 pttt -67.96 -39.33 83.4 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.663 -0.415 . . . . 1.27 110.338 -177.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.559 HD22 HD22 ' A' ' 65' ' ' ASN . 31.1 mt -65.99 -39.84 90.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.309 -0.405 . . . . 0.81 110.8 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.96 -43.94 97.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.935 -0.575 . . . . 1.5 110.337 177.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.2 m -65.25 -36.61 84.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 1.84 110.806 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -85.46 12.06 9.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.858 0.361 . . . . 6.09 111.422 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 54.97 41.08 32.19 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.744 -0.662 . . . . 3.75 111.727 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.559 HD22 HD22 ' A' ' 60' ' ' LEU . 64.8 t30 -113.55 14.08 18.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.568 0.699 . . . . 4.5 109.681 178.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.757 -1.024 . . . . 6.88 111.339 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 tpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.633 -0.506 . . . . 5.32 109.633 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -104.71 113.77 27.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.759 -0.83 . . . . 4.42 108.759 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -136.08 119.35 16.7 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.037 0.446 . . . . 3.38 111.478 -173.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -103.79 143.62 32.57 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.009 -0.738 . . . . 2.64 109.009 171.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.853 HD12 ' HB3' ' A' ' 9' ' ' SER . 1.1 pt? -132.73 167.42 20.15 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.735 -0.666 . . . . 1.18 111.073 -170.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 3.4 pt20 -102.66 166.1 12.55 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.002 -0.999 . . . . 1.22 109.39 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLN . 28.5 Cg_exo -32.39 -42.9 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.317 3.344 . . . . 0.68 114.593 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.04 103.27 13.34 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.116 -0.633 . . . . 1.32 110.19 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.853 ' HB3' HD12 ' A' ' 5' ' ' LEU . 5.7 t -176.6 175.53 1.7 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.099 -1.075 . . . . 0.72 108.099 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.632 HD13 ' HD3' ' A' ' 47' ' ' ARG . 94.8 mt -104.01 109.41 21.17 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.386 0.612 . . . . 1.9 112.333 -170.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.838 HG13 HD11 ' A' ' 5' ' ' LEU . 12.3 m -104.43 156.03 5.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.374 -0.973 . . . . 0.56 108.374 170.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.631 ' O ' HG13 ' A' ' 16' ' ' ILE . 24.6 t70 -110.9 159.95 17.23 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.168 -0.613 . . . . 1.99 111.632 -173.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 16' ' ' ILE . 48.9 tp -51.31 -50.45 59.36 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.304 0.377 . . . . 1.79 111.266 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.599 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 10.0 tmtt? -64.56 -36.97 85.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.669 0.747 . . . . 2.88 109.063 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.94 -39.78 82.67 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.232 -0.895 . . . . 0.71 110.839 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 12' ' ' ASP . 10.7 mt -54.37 -34.69 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 121.042 0.448 . . . . 0.3 110.973 175.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 22' ' ' PHE . 65.1 mtt -65.41 -35.02 79.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.131 0.491 . . . . 1.81 110.372 175.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.43 -30.94 65.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.252 0.548 . . . . 0.69 110.332 173.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 16' ' ' ILE . 9.7 t70 -61.95 -52.57 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.177 -0.919 . . . . 1.34 110.412 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 p -113.22 -59.67 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 1.21 111.947 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 128.2 17.09 2.04 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.003 -0.618 . . . . 0.49 112.136 -179.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.451 ' O ' ' HG2' ' A' ' 17' ' ' MET . 92.6 m-85 -116.99 -179.74 3.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.713 0.292 . . . . 0.71 111.185 -175.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.25 179.31 28.32 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.063 -0.589 . . . . 0.36 113.561 -174.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -45.07 -50.7 10.79 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.652 0.982 . . . . 2.23 113.652 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.9 t -58.57 -42.67 88.48 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.508 0.194 . . . . 0.49 111.377 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.53 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 16.7 t80 -61.03 -48.45 81.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.779 -0.452 . . . . 0.44 109.779 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 16' ' ' ILE . 67.7 mt -56.18 -60.73 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.449 -0.796 . . . . 0.2 111.646 -176.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.428 ' OH ' ' HG2' ' A' ' 45' ' ' ARG . 4.4 m-85 -58.23 -37.53 75.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.379 -0.373 . . . . 0.57 111.17 -174.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -64.03 -57.24 10.27 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.908 0.385 . . . . 0.64 110.511 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.63 ' HB3' ' CD1' ' A' ' 56' ' ' PHE . 3.5 mmp_? -59.01 -50.27 74.74 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.506 -0.77 . . . . 1.06 111.508 -173.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.645 HG21 ' HE1' ' A' ' 48' ' ' TRP . 2.0 mp -66.35 -43.78 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.035 -0.529 . . . . 0.27 111.463 -173.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -64.19 -43.42 95.15 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.369 -0.532 . . . . 1.86 111.043 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.594 ' HB3' ' HE2' ' A' ' 59' ' ' LYS . 30.8 t -66.32 -22.92 66.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.58 . . . . 1.11 110.279 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.39 -64.38 3.25 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 110.794 -0.922 . . . . 0.56 110.794 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.5 t70 179.32 78.99 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 110.101 -0.333 . . . . 0.95 110.101 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.485 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . 93.1 mt 27.53 92.89 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.876 1.36 . . . . 1.0 113.141 169.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HD3' HG22 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -42.81 135.9 4.86 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.995 3.13 . . . . 0.44 114.026 -170.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.627 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 2.9 mptp? -92.63 -0.61 57.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.702 -0.851 . . . . 1.01 108.702 178.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.618 ' HB1' ' HA ' ' A' ' 48' ' ' TRP . . . -45.07 163.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.474 -1.239 . . . . 0.37 112.809 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 40' ' ' LYS . 0.1 OUTLIER -105.88 84.15 2.02 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.317 -0.856 . . . . 1.77 108.991 -175.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 40.9 t -107.62 128.49 62.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 114.855 -1.066 . . . . 1.47 110.135 -174.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -123.06 -10.45 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-O 121.036 0.446 . . . . 1.96 111.269 -174.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -152.89 51.03 0.74 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.066 0.46 . . . . 3.26 111.525 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.71 -29.11 2.07 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 116.118 -0.492 . . . . 1.44 112.613 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HG2' ' OH ' ' A' ' 28' ' ' TYR . 72.5 mtt180 -141.87 160.51 40.04 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.447 -1.316 . . . . 5.04 107.447 174.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' HA ' ' A' ' 41' ' ' VAL . . . 177.26 -93.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.451 0.469 . . . . 0.74 110.657 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HD3' HD13 ' A' ' 10' ' ' LEU . 66.8 mtt180 -136.92 133.33 35.59 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.937 -0.764 . . . . 3.15 108.937 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.645 ' HE1' HG21 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -100.85 147.55 25.98 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.963 0.411 . . . . 0.4 110.224 -175.359 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.597 ' HB2' ' HA ' ' A' ' 39' ' ' ALA . 16.3 tp -95.04 139.05 31.94 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.234 -0.654 . . . . 1.33 109.234 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 77.0 t80 -62.48 -41.47 98.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.335 -0.848 . . . . 0.65 112.187 -173.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' SG ' ' A' ' 54' ' ' CYS . 10.3 ptp180 -53.41 -32.42 49.59 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.805 0.336 . . . . 1.03 111.668 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -61.48 -36.38 80.28 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.622 0.725 . . . . 0.79 109.552 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.879 ' HA ' ' HD2' ' A' ' 56' ' ' PHE . 16.1 m170 -68.9 -38.22 79.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.931 -1.031 . . . . 0.28 108.769 176.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 51' ' ' ARG . 62.9 m -57.27 -47.32 81.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 1.33 110.158 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 58' ' ' ASN . 24.3 mm-40 -64.81 -51.23 63.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.193 0.521 . . . . 1.34 111.027 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.879 ' HD2' ' HA ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -64.04 -50.34 68.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.958 -0.564 . . . . 0.51 111.575 -177.108 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HD3' ' CZ ' ' A' ' 56' ' ' PHE . 10.1 mmmm -56.96 -31.85 65.42 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.067 0.461 . . . . 1.57 110.255 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.659 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 19.1 t30 -59.17 -45.2 91.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.141 -0.936 . . . . 0.92 111.408 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.594 ' HE2' ' HB3' ' A' ' 33' ' ' SER . 0.8 OUTLIER -72.84 -32.52 65.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.107 0.479 . . . . 1.27 109.898 -176.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 65' ' ' ASN . 39.9 mt -74.31 -41.54 60.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.798 -0.637 . . . . 0.81 110.182 177.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.18 -35.51 80.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.036 -0.529 . . . . 1.5 110.29 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.9 t -60.83 -28.53 68.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 1.84 110.487 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -102.45 20.39 17.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.02 -0.536 . . . . 6.09 110.705 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 57.6 39.63 27.44 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.795 -0.639 . . . . 3.75 112.461 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 60' ' ' LEU . 7.6 t30 -90.29 -58.42 2.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.185 0.517 . . . . 4.5 109.972 175.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.0 -1.444 . . . . 6.88 111.197 -177.167 . . . . . . . . 0 0 . 1 stop_ save_